BMRBj - BMREntryMaster

Found 1 Document (1.181 seconds)

BMRB: 6496

1DBF

Backbone 1H and 15N Chemical Shift Assignments for Chorismate Mutase from Bacillus subtilis in complex with prephenate

Authors

Eletsky, A., Kienhofer, A., Hilvert, D., Pervushin, K.

Assembly

BsCM trimer

Entity

1. BsCM (polymer, Thiol state: all free), 127 monomers, 14488.75 × 3 Da Detail

MMIRGIRGAT TVERDTEEEI LQKTKQLLEK IIEENHTKPE DVVQMLLSAT PDLHAVFPAK AVRELSGWQY VPVTCMQEMD VTGGLKKCIR VMMTVQTDVP QDQIRHVYLE KAVVLRPDLS LTKNTEL

2. PRE (non-polymer), 226.183 × 3 Da

Total weight

44144.8 Da

Max. entity weight

14488.75 Da

Source organism

Bacillus subtilis

Exptl. method

NMR

Data set

assigned_chemical_shifts

Chem. Shift Complete

Sequence coverage: 92.9 %, Completeness: 39.3 %, Completeness (bb): 90.4 % Detail

Polymer type: polypeptide(L)

	Total	¹H	¹⁵N
All	39.3 % (360 of 916)	31.0 % (243 of 784)	88.6 % (117 of 132)
Backbone	90.4 % (338 of 374)	87.4 % (221 of 253)	96.7 % (117 of 121)
Sidechain	4.1 % (22 of 542)	4.1 % (22 of 531)	0.0 % (0 of 11)
Aromatic	0.0 % (0 of 26)	0.0 % (0 of 25)	0.0 % (0 of 1)
Methyl	3.5 % (3 of 86)	3.5 % (3 of 86)

1. BsCM

MMIRGIRGAT TVERDTEEEI LQKTKQLLEK IIEENHTKPE DVVQMLLSAT PDLHAVFPAK AVRELSGWQY VPVTCMQEMD VTGGLKKCIR VMMTVQTDVP QDQIRHVYLE KAVVLRPDLS LTKNTEL

Show sample condition

Sample #1

Temperature 293 (±0.1) K, pH 7.5 (±0.1)

#	Name	Isotope labeling	Type	Concentration
1	BsCM	[U-2H; U-13C; U-15N]		0.0 ~ 0.0 mM
2	na

Sample #2

Temperature 293 (±0.1) K, pH 7.5 (±0.1)

#	Name	Isotope labeling	Type	Concentration
3	BsCM	[U-13C; U-15N; U-<35% 2H]		0.0 ~ 0.0 mM
4	na

Sample #3

Temperature 293 (±0.1) K, pH 7.5 (±0.1)

#	Name	Isotope labeling	Type	Concentration
5	BsCM	[U-95% 15N]		0.0 ~ 0.0 mM
6	na

Release date

2005-05-23

Citation

Investigation of ligand binding and protein dynamics in Bacillus subtilis chorismate mutase by transverse relaxation optimized spectroscopy-nuclear magnetic resonance
Eletsky, A., Kienhofer, A., Hilvert, D., Pervushin, K.
Biochemistry (2005), 44, 6788-6799, PubMed 15865424 , DOI 10.1021/bi0474259 , Abstract

Related entities 1. BsCM, : 1 : 4 : 2 : 19 entities Detail

Experiments performed 2 experiments Detail

Chemical shift validation 4 contents Detail

Properties

Input source #1: Assigned chemical shifts - Assigned chemical shifts	bmr6496_3.str
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

Content subtype: bmr6496_3.str

#	Content subtype	Saveframe	Status	# of rows	Experiment type	Sequence coverage (%)
1	Assigned chemical shifts	Backbone_chemical_shifts_of_BsCM_in_complex_with_prephenate	Warning	338		92.9 (chain: 1, length: 127)
1	Chemical shift references	chemical_shift_referencing	OK	3		No information

Assigned chemical shifts

Saveframe: Backbone_chemical_shifts_of_BsCM_in_complex_with_prephenate
- Status: Warning
- Sequence coverage of experimental data
  - Entity_assembly_ID: 1, Chain length: 127, Sequence coverage: 92.9%
- Total number of assignments
  - ¹H chemical shifts: 220
  - ¹⁵N chemical shifts: 118
- Completeness of assignments
  - Entity_assemble_ID: 1
- Histogram of normalized assigned chemical shifts
- Random coil index and derived parameters (S² and NMR RMSD)
  - Chain_ID: 1

Atom group	# of target shifts	# of assigned shifts	Completeness (%)
¹H chemical shifts	784	220	28.1
¹⁵N chemical shifts	139	117	84.2

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Found 1 Document (1.181 seconds)

BMRB: 6496

Sample #1

Sample #2

Sample #3

Related entities 1. BsCM, : 1 : 4 : 2 : 19 entities Detail

Experiments performed 2 experiments Detail

Instrument

Sample #1

Sample #2

Sample #3

Instrument

Sample #1

Sample #2

Sample #3

Chemical shift validation 4 contents Detail

Atom group	# of target shifts	# of assigned shifts	Completeness (%)
¹H chemical shifts	253	220	87.0
¹⁵N chemical shifts	121	117	96.7