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BMRB: 17965

2LJW

Solution NMR structure of Alr2454 protein from Nostoc sp. strain PCC 7120, Northeast Structural Genomics Consortium Target NsR264

Authors

Aramini, J.M., Lee, D., Ciccosanti, C., Janjua, H., Rost, B., Acton, T.B., Xiao, R., Everett, J.K., Montelione, G.T.

Assembly

NsR264

Entity

1. NsR264 (polymer, Thiol state: not present), 110 monomers, 12972.60 Da Detail

MTGQELRQLL LDKWGYSYDV QFRRTQGKIF LQVMWKYLEQ ASFPMNETEY QEHLDSVANY LHALGGAVQV KTFITQTKER PRLGKAVSIP LDLGERASEW IILEHHHHHH

Formula weight

12972.6 Da

Source organism

Nostoc sp.

Exptl. method

solution NMR

Refine. method

simulated annealing

Data set

assigned_chemical_shifts

Chem. Shift Complete

Sequence coverage: 95.5 %, Completeness: 94.6 %, Completeness (bb): 94.0 % Detail

Polymer type: polypeptide(L)

	Total	¹H	¹³C	¹⁵N
All	94.6 % (1277 of 1350)	94.7 % (666 of 703)	94.5 % (497 of 526)	94.2 % (114 of 121)
Backbone	94.0 % (615 of 654)	92.9 % (208 of 224)	95.0 % (307 of 323)	93.5 % (100 of 107)
Sidechain	95.1 % (760 of 799)	95.6 % (458 of 479)	94.1 % (288 of 306)	100.0 % (14 of 14)
Aromatic	83.8 % (124 of 148)	85.1 % (63 of 74)	81.7 % (58 of 71)	100.0 % (3 of 3)
Methyl	100.0 % (120 of 120)	100.0 % (60 of 60)	100.0 % (60 of 60)

1. NsR264

MTGQELRQLL LDKWGYSYDV QFRRTQGKIF LQVMWKYLEQ ASFPMNETEY QEHLDSVANY LHALGGAVQV KTFITQTKER PRLGKAVSIP LDLGERASEW IILEHHHHHH

Show sample condition

Sample #1

Solvent system 90% H2O/10% D2O, Pressure 1 atm, Temperature 298 K, pH 4.5, Details 1.01 mM [U-100% 13C; U-100% 15N] NsR264, 90% H2O/10% D2O

#	Name	Isotope labeling	Concentration
1	NsR264	[U-100% 13C; U-100% 15N]	1.01 mM
2	ammonium acetate	natural abundance	20 mM
3	sodium chloride	natural abundance	100 mM
4	calcium chloride	natural abundance	5 mM
5	DTT	natural abundance	10 mM
6	sodium azide	natural abundance	0.02 %
7	DSS	natural abundance	50 uM
8	H2O	natural abundance	90 %
9	D2O	natural abundance	10 %

Sample #2

Solvent system 90% H2O/10% D2O, Pressure 1 atm, Temperature 298 K, pH 4.5, Details 0.567 mM [U-5% 13C; U-100% 15N] NsR264, 90% H2O/10% D2O

#	Name	Isotope labeling	Concentration
10	NsR264	[U-5% 13C; U-100% 15N]	0.567 mM
11	ammonium acetate	natural abundance	20 mM
12	sodium chloride	natural abundance	100 mM
13	calcium chloride	natural abundance	5 mM
14	DTT	natural abundance	10 mM
15	sodium azide	natural abundance	0.02 %
16	DSS	natural abundance	50 uM
17	H2O	natural abundance	90 %
18	D2O	natural abundance	10 %

LACS Plot; CA

Atom type	Mol. common name	Atom group	Ref. method	Ref. type	Shift ratio
¹³C	DSS	methyl protons	na	indirect	0.2514495
¹H	DSS	methyl protons	internal	direct	1.0
¹⁵N	DSS	methyl protons	na	indirect	0.1013291

Referencing offset: -0.2 ppm, Outliers: 1 Detail

LACS Plot; CB

Atom type	Mol. common name	Atom group	Ref. method	Ref. type	Shift ratio
¹³C	DSS	methyl protons	na	indirect	0.2514495
¹H	DSS	methyl protons	internal	direct	1.0
¹⁵N	DSS	methyl protons	na	indirect	0.1013291

Referencing offset: -0.2 ppm, Outliers: 1 Detail

LACS Plot; HA

Atom type	Mol. common name	Atom group	Ref. method	Ref. type	Shift ratio
¹³C	DSS	methyl protons	na	indirect	0.2514495
¹H	DSS	methyl protons	internal	direct	1.0
¹⁵N	DSS	methyl protons	na	indirect	0.1013291

Referencing offset: -0.05 ppm, Outliers: 2 Detail

LACS Plot; CO

Atom type	Mol. common name	Atom group	Ref. method	Ref. type	Shift ratio
¹³C	DSS	methyl protons	na	indirect	0.2514495
¹H	DSS	methyl protons	internal	direct	1.0
¹⁵N	DSS	methyl protons	na	indirect	0.1013291

Referencing offset: -0.11 ppm, Outliers: 1 Detail

Protein Blocks Logo

Calculated from 20 models in PDB: 2LJW, Strand ID: A Detail

Release date

2011-10-23

Related entities 1. NsR264, : 1 : 3 entities Detail

Experiments performed 18 experiments Detail

1 2D 1H-15N HSQC

Instrument

Bruker Avance - 800 MHz 5-mm TXI cryoprobe

Sample

State isotropic, Solvent system 90% H2O/10% D2O, Pressure 1 atm, Temperature 298 K, pH 4.5, Details 1.01 mM [U-100% 13C; U-100% 15N] NsR264, 90% H2O/10% D2O

#	Name	Isotope labeling	Concentration
1	NsR264	[U-100% 13C; U-100% 15N]	1.01 mM
2	ammonium acetate	natural abundance	20 mM
3	sodium chloride	natural abundance	100 mM
4	calcium chloride	natural abundance	5 mM
5	DTT	natural abundance	10 mM
6	sodium azide	natural abundance	0.02 %
7	DSS	natural abundance	50 uM
8	H2O	natural abundance	90 %
9	D2O	natural abundance	10 %

2 2D 1H-13C HSQC

Instrument

Bruker Avance - 800 MHz 5-mm TXI cryoprobe

Sample

State isotropic, Solvent system 90% H2O/10% D2O, Pressure 1 atm, Temperature 298 K, pH 4.5, Details 1.01 mM [U-100% 13C; U-100% 15N] NsR264, 90% H2O/10% D2O

#	Name	Isotope labeling	Concentration
1	NsR264	[U-100% 13C; U-100% 15N]	1.01 mM
2	ammonium acetate	natural abundance	20 mM
3	sodium chloride	natural abundance	100 mM
4	calcium chloride	natural abundance	5 mM
5	DTT	natural abundance	10 mM
6	sodium azide	natural abundance	0.02 %
7	DSS	natural abundance	50 uM
8	H2O	natural abundance	90 %
9	D2O	natural abundance	10 %

3 3D 1H-15N NOESY

Instrument

Bruker Avance - 800 MHz 5-mm TXI cryoprobe

Sample

State isotropic, Solvent system 90% H2O/10% D2O, Pressure 1 atm, Temperature 298 K, pH 4.5, Details 1.01 mM [U-100% 13C; U-100% 15N] NsR264, 90% H2O/10% D2O

#	Name	Isotope labeling	Concentration
1	NsR264	[U-100% 13C; U-100% 15N]	1.01 mM
2	ammonium acetate	natural abundance	20 mM
3	sodium chloride	natural abundance	100 mM
4	calcium chloride	natural abundance	5 mM
5	DTT	natural abundance	10 mM
6	sodium azide	natural abundance	0.02 %
7	DSS	natural abundance	50 uM
8	H2O	natural abundance	90 %
9	D2O	natural abundance	10 %

4 3D 1H-13C NOESY aliphatic

Instrument

Bruker Avance - 800 MHz 5-mm TXI cryoprobe

Sample

State isotropic, Solvent system 90% H2O/10% D2O, Pressure 1 atm, Temperature 298 K, pH 4.5, Details 1.01 mM [U-100% 13C; U-100% 15N] NsR264, 90% H2O/10% D2O

#	Name	Isotope labeling	Concentration
1	NsR264	[U-100% 13C; U-100% 15N]	1.01 mM
2	ammonium acetate	natural abundance	20 mM
3	sodium chloride	natural abundance	100 mM
4	calcium chloride	natural abundance	5 mM
5	DTT	natural abundance	10 mM
6	sodium azide	natural abundance	0.02 %
7	DSS	natural abundance	50 uM
8	H2O	natural abundance	90 %
9	D2O	natural abundance	10 %

5 3D 1H-13C NOESY aromatic

Instrument

Bruker Avance - 800 MHz 5-mm TXI cryoprobe

Sample

State isotropic, Solvent system 90% H2O/10% D2O, Pressure 1 atm, Temperature 298 K, pH 4.5, Details 1.01 mM [U-100% 13C; U-100% 15N] NsR264, 90% H2O/10% D2O

#	Name	Isotope labeling	Concentration
1	NsR264	[U-100% 13C; U-100% 15N]	1.01 mM
2	ammonium acetate	natural abundance	20 mM
3	sodium chloride	natural abundance	100 mM
4	calcium chloride	natural abundance	5 mM
5	DTT	natural abundance	10 mM
6	sodium azide	natural abundance	0.02 %
7	DSS	natural abundance	50 uM
8	H2O	natural abundance	90 %
9	D2O	natural abundance	10 %

6 2D 1H-13C HSQC high resolution (L/V methyl stereoassignment)

Instrument

Bruker Avance - 800 MHz 5-mm TXI cryoprobe

Sample

State isotropic, Solvent system 90% H2O/10% D2O, Pressure 1 atm, Temperature 298 K, pH 4.5, Details 0.567 mM [U-5% 13C; U-100% 15N] NsR264, 90% H2O/10% D2O

#	Name	Isotope labeling	Concentration
10	NsR264	[U-5% 13C; U-100% 15N]	0.567 mM
11	ammonium acetate	natural abundance	20 mM
12	sodium chloride	natural abundance	100 mM
13	calcium chloride	natural abundance	5 mM
14	DTT	natural abundance	10 mM
15	sodium azide	natural abundance	0.02 %
16	DSS	natural abundance	50 uM
17	H2O	natural abundance	90 %
18	D2O	natural abundance	10 %

7 3D HNCO

Instrument

Bruker Avance - 600 MHz 1.7-mm TCI microcryoprobe

Sample

State isotropic, Solvent system 90% H2O/10% D2O, Pressure 1 atm, Temperature 298 K, pH 4.5, Details 1.01 mM [U-100% 13C; U-100% 15N] NsR264, 90% H2O/10% D2O

#	Name	Isotope labeling	Concentration
1	NsR264	[U-100% 13C; U-100% 15N]	1.01 mM
2	ammonium acetate	natural abundance	20 mM
3	sodium chloride	natural abundance	100 mM
4	calcium chloride	natural abundance	5 mM
5	DTT	natural abundance	10 mM
6	sodium azide	natural abundance	0.02 %
7	DSS	natural abundance	50 uM
8	H2O	natural abundance	90 %
9	D2O	natural abundance	10 %

8 3D HN(CA)CO

Instrument

Bruker Avance - 600 MHz 1.7-mm TCI microcryoprobe

Sample

State isotropic, Solvent system 90% H2O/10% D2O, Pressure 1 atm, Temperature 298 K, pH 4.5, Details 1.01 mM [U-100% 13C; U-100% 15N] NsR264, 90% H2O/10% D2O

#	Name	Isotope labeling	Concentration
1	NsR264	[U-100% 13C; U-100% 15N]	1.01 mM
2	ammonium acetate	natural abundance	20 mM
3	sodium chloride	natural abundance	100 mM
4	calcium chloride	natural abundance	5 mM
5	DTT	natural abundance	10 mM
6	sodium azide	natural abundance	0.02 %
7	DSS	natural abundance	50 uM
8	H2O	natural abundance	90 %
9	D2O	natural abundance	10 %

9 3D HNCA

Instrument

Bruker Avance - 600 MHz 1.7-mm TCI microcryoprobe

Sample

State isotropic, Solvent system 90% H2O/10% D2O, Pressure 1 atm, Temperature 298 K, pH 4.5, Details 1.01 mM [U-100% 13C; U-100% 15N] NsR264, 90% H2O/10% D2O

#	Name	Isotope labeling	Concentration
1	NsR264	[U-100% 13C; U-100% 15N]	1.01 mM
2	ammonium acetate	natural abundance	20 mM
3	sodium chloride	natural abundance	100 mM
4	calcium chloride	natural abundance	5 mM
5	DTT	natural abundance	10 mM
6	sodium azide	natural abundance	0.02 %
7	DSS	natural abundance	50 uM
8	H2O	natural abundance	90 %
9	D2O	natural abundance	10 %

10 3D HN(CO)CA

Instrument

Bruker Avance - 600 MHz 1.7-mm TCI microcryoprobe

Sample

State isotropic, Solvent system 90% H2O/10% D2O, Pressure 1 atm, Temperature 298 K, pH 4.5, Details 1.01 mM [U-100% 13C; U-100% 15N] NsR264, 90% H2O/10% D2O

#	Name	Isotope labeling	Concentration
1	NsR264	[U-100% 13C; U-100% 15N]	1.01 mM
2	ammonium acetate	natural abundance	20 mM
3	sodium chloride	natural abundance	100 mM
4	calcium chloride	natural abundance	5 mM
5	DTT	natural abundance	10 mM
6	sodium azide	natural abundance	0.02 %
7	DSS	natural abundance	50 uM
8	H2O	natural abundance	90 %
9	D2O	natural abundance	10 %

11 3D CBCA(CO)NH

Instrument

Bruker Avance - 600 MHz 1.7-mm TCI microcryoprobe

Sample

State isotropic, Solvent system 90% H2O/10% D2O, Pressure 1 atm, Temperature 298 K, pH 4.5, Details 1.01 mM [U-100% 13C; U-100% 15N] NsR264, 90% H2O/10% D2O

#	Name	Isotope labeling	Concentration
1	NsR264	[U-100% 13C; U-100% 15N]	1.01 mM
2	ammonium acetate	natural abundance	20 mM
3	sodium chloride	natural abundance	100 mM
4	calcium chloride	natural abundance	5 mM
5	DTT	natural abundance	10 mM
6	sodium azide	natural abundance	0.02 %
7	DSS	natural abundance	50 uM
8	H2O	natural abundance	90 %
9	D2O	natural abundance	10 %

12 3D HNCACB

Instrument

Bruker Avance - 600 MHz 1.7-mm TCI microcryoprobe

Sample

State isotropic, Solvent system 90% H2O/10% D2O, Pressure 1 atm, Temperature 298 K, pH 4.5, Details 1.01 mM [U-100% 13C; U-100% 15N] NsR264, 90% H2O/10% D2O

#	Name	Isotope labeling	Concentration
1	NsR264	[U-100% 13C; U-100% 15N]	1.01 mM
2	ammonium acetate	natural abundance	20 mM
3	sodium chloride	natural abundance	100 mM
4	calcium chloride	natural abundance	5 mM
5	DTT	natural abundance	10 mM
6	sodium azide	natural abundance	0.02 %
7	DSS	natural abundance	50 uM
8	H2O	natural abundance	90 %
9	D2O	natural abundance	10 %

13 3D HBHA(CO)NH

Instrument

Bruker Avance - 600 MHz 1.7-mm TCI microcryoprobe

Sample

State isotropic, Solvent system 90% H2O/10% D2O, Pressure 1 atm, Temperature 298 K, pH 4.5, Details 1.01 mM [U-100% 13C; U-100% 15N] NsR264, 90% H2O/10% D2O

#	Name	Isotope labeling	Concentration
1	NsR264	[U-100% 13C; U-100% 15N]	1.01 mM
2	ammonium acetate	natural abundance	20 mM
3	sodium chloride	natural abundance	100 mM
4	calcium chloride	natural abundance	5 mM
5	DTT	natural abundance	10 mM
6	sodium azide	natural abundance	0.02 %
7	DSS	natural abundance	50 uM
8	H2O	natural abundance	90 %
9	D2O	natural abundance	10 %

14 3D HCCH-TOCSY

Instrument

Bruker Avance - 600 MHz 1.7-mm TCI microcryoprobe

Sample

State isotropic, Solvent system 90% H2O/10% D2O, Pressure 1 atm, Temperature 298 K, pH 4.5, Details 1.01 mM [U-100% 13C; U-100% 15N] NsR264, 90% H2O/10% D2O

#	Name	Isotope labeling	Concentration
1	NsR264	[U-100% 13C; U-100% 15N]	1.01 mM
2	ammonium acetate	natural abundance	20 mM
3	sodium chloride	natural abundance	100 mM
4	calcium chloride	natural abundance	5 mM
5	DTT	natural abundance	10 mM
6	sodium azide	natural abundance	0.02 %
7	DSS	natural abundance	50 uM
8	H2O	natural abundance	90 %
9	D2O	natural abundance	10 %

15 3D CCH-TOCSY

Instrument

Bruker Avance - 600 MHz 1.7-mm TCI microcryoprobe

Sample

State isotropic, Solvent system 90% H2O/10% D2O, Pressure 1 atm, Temperature 298 K, pH 4.5, Details 1.01 mM [U-100% 13C; U-100% 15N] NsR264, 90% H2O/10% D2O

#	Name	Isotope labeling	Concentration
1	NsR264	[U-100% 13C; U-100% 15N]	1.01 mM
2	ammonium acetate	natural abundance	20 mM
3	sodium chloride	natural abundance	100 mM
4	calcium chloride	natural abundance	5 mM
5	DTT	natural abundance	10 mM
6	sodium azide	natural abundance	0.02 %
7	DSS	natural abundance	50 uM
8	H2O	natural abundance	90 %
9	D2O	natural abundance	10 %

16 3D HCCH COSY

Instrument

Bruker Avance - 600 MHz 1.7-mm TCI microcryoprobe

Sample

State isotropic, Solvent system 90% H2O/10% D2O, Pressure 1 atm, Temperature 298 K, pH 4.5, Details 1.01 mM [U-100% 13C; U-100% 15N] NsR264, 90% H2O/10% D2O

#	Name	Isotope labeling	Concentration
1	NsR264	[U-100% 13C; U-100% 15N]	1.01 mM
2	ammonium acetate	natural abundance	20 mM
3	sodium chloride	natural abundance	100 mM
4	calcium chloride	natural abundance	5 mM
5	DTT	natural abundance	10 mM
6	sodium azide	natural abundance	0.02 %
7	DSS	natural abundance	50 uM
8	H2O	natural abundance	90 %
9	D2O	natural abundance	10 %

17 1D 15N T1 and T2

Instrument

Bruker Avance - 600 MHz 1.7-mm TCI microcryoprobe

Sample

State isotropic, Solvent system 90% H2O/10% D2O, Pressure 1 atm, Temperature 298 K, pH 4.5, Details 1.01 mM [U-100% 13C; U-100% 15N] NsR264, 90% H2O/10% D2O

#	Name	Isotope labeling	Concentration
1	NsR264	[U-100% 13C; U-100% 15N]	1.01 mM
2	ammonium acetate	natural abundance	20 mM
3	sodium chloride	natural abundance	100 mM
4	calcium chloride	natural abundance	5 mM
5	DTT	natural abundance	10 mM
6	sodium azide	natural abundance	0.02 %
7	DSS	natural abundance	50 uM
8	H2O	natural abundance	90 %
9	D2O	natural abundance	10 %

18 2D 1H-15N hetNOE

Instrument

Bruker Avance - 800 MHz 5-mm TXI cryoprobe

Sample

State isotropic, Solvent system 90% H2O/10% D2O, Pressure 1 atm, Temperature 298 K, pH 4.5, Details 1.01 mM [U-100% 13C; U-100% 15N] NsR264, 90% H2O/10% D2O

#	Name	Isotope labeling	Concentration
1	NsR264	[U-100% 13C; U-100% 15N]	1.01 mM
2	ammonium acetate	natural abundance	20 mM
3	sodium chloride	natural abundance	100 mM
4	calcium chloride	natural abundance	5 mM
5	DTT	natural abundance	10 mM
6	sodium azide	natural abundance	0.02 %
7	DSS	natural abundance	50 uM
8	H2O	natural abundance	90 %
9	D2O	natural abundance	10 %

NMR combined restraints 4 contents Detail

Properties

Input source #1: NMR data (NEF) - Assigned chemical shifts, Distance restraints, Dihedral angle restraints	combined_17965_2ljw.nef
Input source #2: Coordindates	2ljw.cif
Diamagnetism of the molecular assembly	True (excluding Oxygen atoms)
Whether the assembly has a disulfide bond	None
Whether the assembly has a other bond	None
Whether the assembly contains a cyclic polymer	None
Overall data processing status	Warning

Disulfide bonds

None

Other bonds (neither disulfide, covalent nor hydrogen bonds, e.g. Zinc–sulphur bond)

None

Non-standard residues

None

Sequence alignments

Entity_assembly_ID (NMR): A vs Auth_asym_ID (model): A

--------10--------20--------30--------40--------50--------60--------70--------80--------90-------100
MTGQELRQLLLDKWGYSYDVQFRRTQGKIFLQVMWKYLEQASFPMNETEYQEHLDSVANYLHALGGAVQVKTFITQTKERPRLGKAVSIPLDLGERASEW
||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
MTGQELRQLLLDKWGYSYDVQFRRTQGKIFLQVMWKYLEQASFPMNETEYQEHLDSVANYLHALGGAVQVKTFITQTKERPRLGKAVSIPLDLGERASEW

-------110
IILEHHHHHH
||||||||||
IILEHHHHHH

Chain assignments

Entity_assembly_ID (NMR)	Auth_asym_ID (model)	Length	Unmapped	Conflict	Sequence coverage (%)
A	A	110	0	0	100.0

Content subtype: combined_17965_2ljw.nef

#	Content subtype	Saveframe	Status	# of rows (sets)	Experiment type	Sequence coverage (%)
1	Assigned chemical shifts	assigned_chem_shift_list_1	Warning	1283		94.5 (chain: A, length: 110)
1	Distance restraints	CNS/XPLOR_distance_constraints_2	OK	2995 (1)	noe	94.5 (chain: A, length: 110)
1	Dihedral angle restraints	CNS/XPLOR_dihedral_3	OK	162 (162)	.	88.2 (chain: A, length: 110)

Assigned chemical shifts

Saveframe: assigned_chem_shift_list_1
- Status: Warning
- Sequence coverage of experimental data
  - Entity_assembly_ID: A, Chain length: 110, Sequence coverage: 94.5%
- Total number of assignments
  - ¹H chemical shifts: 664
  - ¹³C chemical shifts: 500
  - ¹⁵N chemical shifts: 119
- Completeness of assignments
  - Entity_assemble_ID: A
- Peptide bond of PRO
- Tautomeric state of HIS
- Rotameric state of ILE , LEU, and VAL
- Histogram of normalized assigned chemical shifts
- Random coil index and derived parameters (S² and NMR RMSD)
  - Chain_ID: A

Comp_index_ID	Comp_ID	Atom_ID	CS value (ppm)
4	GLN	CD	180.075
8	GLN	CD	180.382
21	GLN	CD	180.046
26	GLN	CD	181.058
32	GLN	CD	179.505
46	ASN	CG	175.892
51	GLN	CD	179.8
59	ASN	CG	176.111
69	GLN	CD	180.041
76	GLN	CD	180.274

Atom group	# of target shifts	# of assigned shifts	Completeness (%)
¹H chemical shifts	703	664	94.5
¹³C chemical shifts	526	490	93.2
¹⁵N chemical shifts	127	119	93.7

Atom group	# of target shifts	# of assigned shifts	Completeness (%)
¹H chemical shifts	224	210	93.8
¹³C chemical shifts	220	207	94.1
¹⁵N chemical shifts	107	99	92.5

Atom group	# of target shifts	# of assigned shifts	Completeness (%)
¹H chemical shifts	479	454	94.8
¹³C chemical shifts	306	283	92.5
¹⁵N chemical shifts	20	20	100.0

Atom group	# of target shifts	# of assigned shifts	Completeness (%)
¹H chemical shifts	63	63	100.0
¹³C chemical shifts	63	63	100.0

Atom group	# of target shifts	# of assigned shifts	Completeness (%)
¹H chemical shifts	74	61	82.4
¹³C chemical shifts	71	54	76.1
¹⁵N chemical shifts	3	3	100.0

Distance restraints

Saveframe: CNS/XPLOR_distance_constraints_2
- Status: OK
- Experiment type: noe
- Sequence coverage of experimental data
  - Entity_assembly_ID: A, Chain length: 110, Sequence coverage: 94.5%
- Total number of restraints: 2986
- Weight of restraints: 1.0 (2986)
- Potential type of restraints: square-well-parabolic (2986)
- Range of distance target values: 2.14, 3.92 (Å)
- Histogram of distance target values
- Histogram of discrepancy in distance target values
- Distance restraints per residue
  - Chain_ID: A
- Distance restraints on contact map

Dihedral angle restraints

Saveframe: CNS/XPLOR_dihedral_3
- Status: OK
- Experiment type: .
- Sequence coverage of experimental data
  - Entity_assembly_ID: A, Chain length: 110, Sequence coverage: 88.2%
- Total number of restraints: 162
- Total number of restraints per polymer type: 162
- Weight of restraints: 1.0 (162)
- Potential type of restraints: square-well-parabolic (162)
- Plot of Phi-Psi angle restraints
- Plot of Chi1-Chi2 angle restraints
- Dihedral angle restraints per residue
  - Chain_ID: A

Keywords DUF3067, NMR structure, PF11267, novel fold, structural genomics, NORTHEAST STRUCTURAL GENOMICS CONSORTIUM (NESG), PSI-2, Protein NMR, Protein Structure Initiative, Structural Genomics, Target NsR264

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Found 1 Document (0.785 seconds)

BMRB: 17965

Sample #1

Sample #2

Chemical shift reference

Chemical shift reference

Chemical shift reference

Chemical shift reference

Related entities 1. NsR264, : 1 : 3 entities Detail

Experiments performed 18 experiments Detail

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Instrument

Sample

Instrument

Sample

Instrument

Sample

Instrument

Sample

Instrument

Sample

Instrument

Sample

Instrument

Sample

Instrument

Sample

Instrument

Sample

Instrument

Sample

NMR combined restraints 4 contents Detail