BMRBj - BMREntryMaster

Found 1 Document (2.466 seconds)

BMRB: 5189

1NSH

1H, 15N and 13C resonance assignments of rabbit apo-S100A11

Authors

Rintala, A.C., Schonekess, B.O., Walsh, M.P., Shaw, G.S.

Assembly

S100A11 homodimer

Entity

1. S100A11 homodimer (polymer, Thiol state: all free), 102 monomers, 11429.01 × 2 Da Detail

MSRPTETERC IESLIAVFQK YAGKDGHSVT LSKTEFLSFM NTELAAFTKN QKDPGVLDRM MKKLDLNSDG QLDFQEFLNL IGGLAVACHE SFVKAAPPQK RF

Total weight

22858.02 Da

Max. entity weight

11429.01 Da

Source organism

Oryctolagus cuniculus

Exptl. method

NMR

Refine. method

simulated annealing

Data set

assigned_chemical_shifts

Chem. Shift Complete

Sequence coverage: 98.0 %, Completeness: 92.2 %, Completeness (bb): 95.5 % Detail

Polymer type: polypeptide(L)

	Total	¹H	¹³C	¹⁵N
All	92.2 % (1111 of 1205)	93.0 % (585 of 629)	90.0 % (422 of 469)	97.2 % (104 of 107)
Backbone	95.5 % (577 of 604)	96.1 % (198 of 206)	94.7 % (284 of 300)	96.9 % (95 of 98)
Sidechain	89.4 % (623 of 697)	90.8 % (384 of 423)	86.8 % (230 of 265)	100.0 % (9 of 9)
Aromatic	57.3 % (55 of 96)	70.8 % (34 of 48)	43.8 % (21 of 48)
Methyl	98.1 % (102 of 104)	98.1 % (51 of 52)	98.1 % (51 of 52)

1. S100A11

MSRPTETERC IESLIAVFQK YAGKDGHSVT LSKTEFLSFM NTELAAFTKN QKDPGVLDRM MKKLDLNSDG QLDFQEFLNL IGGLAVACHE SFVKAAPPQK RF

Show sample condition

Sample #1

Temperature 308 (±0.1) K, pH 7.25 (±0.01)

#	Name	Isotope labeling	Type	Concentration
1	S100A11	[U-15N; U-13C]		2.0 mM

Sample #2

Temperature 308 (±0.1) K, pH 7.25 (±0.01)

#	Name	Isotope labeling	Type	Concentration
2	S100A11	[U-15N]-Gly,Ser S100A11		2.0 mM

LACS Plot; CA

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

Referencing offset: -0.19 ppm, Outliers: 1 Detail

LACS Plot; CB

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

Referencing offset: -0.19 ppm, Outliers: 1 Detail

LACS Plot; HA

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

Referencing offset: -0.06 ppm, Outliers: 1 Detail

LACS Plot; CO

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

Referencing offset: -0.21 ppm, Outliers: 1 Detail

Protein Blocks Logo

Calculated from 19 models in PDB: 1NSH, Strand ID: A, B Detail

Release date

2002-05-06

Citation 1

1H, 15N and 13C resonance assignments of rabbit apo-S100A11
Rintala, A.C., Schonekess, B.O., Walsh, M.P., Shaw, G.S.
J. Biomol. NMR (2002), 22, 191-192, PubMed 11883784 , Abstract

Show more 2 citaions

Citation 2

NMRPipe: a multidimensional spectral processing system based on UNIX pipes
Delaglio, F., Grzesiek, S., Vuister, G.W., Zhu, G., Pfeifer, J., Bax, A.
J. Biomol. NMR (1995), 6, 277-293, PubMed 8520220 , DOI 10.1007/bf00197809 , Abstract

Citation 3

A short recollection on the paper entitled "A common sense approach to peak picking in two-, three-, and four-dimensional spectra using automatic computer analysis of contour diagrams" by D.S. Garrett, R. Powers, A.M. Gronenborn, and G.M. Clore [J. Magn. Reson. 95 (1991) 214-220]
J. Magn. Reson. (2011), 213, 364-365, PubMed 22152356 , DOI 10.1016/j.jmr.2011.08.009 , Abstract

Hide non-primary 2 citaions

Related entities 1. S100A11 homodimer, : 1 : 1 : 240 entities Detail

Interaction partners 1. S100A11 homodimer, : 15 interactors Detail

More details for 15 interactors identified by 10 citations

Experiments performed 11 experiments Detail

1 1H-15N HSQC

Instrument

#1 Model Varian UNITY (500 MHz)

#2 Model Varian INOVA (600 MHz)

#3 Model Varian INOVA (800 MHz)

Sample #1

Temperature 308 (±0.1) K, pH 7.25 (±0.01)

#	Name	Isotope labeling	Type	Concentration
1	S100A11	[U-15N; U-13C]		2.0 mM

Sample #2

Temperature 308 (±0.1) K, pH 7.25 (±0.01)

#	Name	Isotope labeling	Type	Concentration
2	S100A11	[U-15N]-Gly,Ser S100A11		2.0 mM

2 HNCA

Instrument

#1 Model Varian UNITY (500 MHz)

#2 Model Varian INOVA (600 MHz)

#3 Model Varian INOVA (800 MHz)

Sample #1

Temperature 308 (±0.1) K, pH 7.25 (±0.01)

#	Name	Isotope labeling	Type	Concentration
1	S100A11	[U-15N; U-13C]		2.0 mM

Sample #2

Temperature 308 (±0.1) K, pH 7.25 (±0.01)

#	Name	Isotope labeling	Type	Concentration
2	S100A11	[U-15N]-Gly,Ser S100A11		2.0 mM

3 HN(CO)CA

Instrument

#1 Model Varian UNITY (500 MHz)

#2 Model Varian INOVA (600 MHz)

#3 Model Varian INOVA (800 MHz)

Sample #1

Temperature 308 (±0.1) K, pH 7.25 (±0.01)

#	Name	Isotope labeling	Type	Concentration
1	S100A11	[U-15N; U-13C]		2.0 mM

Sample #2

Temperature 308 (±0.1) K, pH 7.25 (±0.01)

#	Name	Isotope labeling	Type	Concentration
2	S100A11	[U-15N]-Gly,Ser S100A11		2.0 mM

4 HC(CO)NH

Instrument

#1 Model Varian UNITY (500 MHz)

#2 Model Varian INOVA (600 MHz)

#3 Model Varian INOVA (800 MHz)

Sample #1

Temperature 308 (±0.1) K, pH 7.25 (±0.01)

#	Name	Isotope labeling	Type	Concentration
1	S100A11	[U-15N; U-13C]		2.0 mM

Sample #2

Temperature 308 (±0.1) K, pH 7.25 (±0.01)

#	Name	Isotope labeling	Type	Concentration
2	S100A11	[U-15N]-Gly,Ser S100A11		2.0 mM

5 HNCACB

Instrument

#1 Model Varian UNITY (500 MHz)

#2 Model Varian INOVA (600 MHz)

#3 Model Varian INOVA (800 MHz)

Sample #1

Temperature 308 (±0.1) K, pH 7.25 (±0.01)

#	Name	Isotope labeling	Type	Concentration
1	S100A11	[U-15N; U-13C]		2.0 mM

Sample #2

Temperature 308 (±0.1) K, pH 7.25 (±0.01)

#	Name	Isotope labeling	Type	Concentration
2	S100A11	[U-15N]-Gly,Ser S100A11		2.0 mM

6 CBCA(CO)NH

Instrument

#1 Model Varian UNITY (500 MHz)

#2 Model Varian INOVA (600 MHz)

#3 Model Varian INOVA (800 MHz)

Sample #1

Temperature 308 (±0.1) K, pH 7.25 (±0.01)

#	Name	Isotope labeling	Type	Concentration
1	S100A11	[U-15N; U-13C]		2.0 mM

Sample #2

Temperature 308 (±0.1) K, pH 7.25 (±0.01)

#	Name	Isotope labeling	Type	Concentration
2	S100A11	[U-15N]-Gly,Ser S100A11		2.0 mM

7 HNCO

Instrument

#1 Model Varian UNITY (500 MHz)

#2 Model Varian INOVA (600 MHz)

#3 Model Varian INOVA (800 MHz)

Sample #1

Temperature 308 (±0.1) K, pH 7.25 (±0.01)

#	Name	Isotope labeling	Type	Concentration
1	S100A11	[U-15N; U-13C]		2.0 mM

Sample #2

Temperature 308 (±0.1) K, pH 7.25 (±0.01)

#	Name	Isotope labeling	Type	Concentration
2	S100A11	[U-15N]-Gly,Ser S100A11		2.0 mM

8 C(CO)NH

Instrument

#1 Model Varian UNITY (500 MHz)

#2 Model Varian INOVA (600 MHz)

#3 Model Varian INOVA (800 MHz)

Sample #1

Temperature 308 (±0.1) K, pH 7.25 (±0.01)

#	Name	Isotope labeling	Type	Concentration
1	S100A11	[U-15N; U-13C]		2.0 mM

Sample #2

Temperature 308 (±0.1) K, pH 7.25 (±0.01)

#	Name	Isotope labeling	Type	Concentration
2	S100A11	[U-15N]-Gly,Ser S100A11		2.0 mM

9 1H-15N TOCSY

Instrument

#1 Model Varian UNITY (500 MHz)

#2 Model Varian INOVA (600 MHz)

#3 Model Varian INOVA (800 MHz)

Sample #1

Temperature 308 (±0.1) K, pH 7.25 (±0.01)

#	Name	Isotope labeling	Type	Concentration
1	S100A11	[U-15N; U-13C]		2.0 mM

Sample #2

Temperature 308 (±0.1) K, pH 7.25 (±0.01)

#	Name	Isotope labeling	Type	Concentration
2	S100A11	[U-15N]-Gly,Ser S100A11		2.0 mM

10 13C-HSQC

Instrument

#1 Model Varian UNITY (500 MHz)

#2 Model Varian INOVA (600 MHz)

#3 Model Varian INOVA (800 MHz)

Sample #1

Temperature 308 (±0.1) K, pH 7.25 (±0.01)

#	Name	Isotope labeling	Type	Concentration
1	S100A11	[U-15N; U-13C]		2.0 mM

Sample #2

Temperature 308 (±0.1) K, pH 7.25 (±0.01)

#	Name	Isotope labeling	Type	Concentration
2	S100A11	[U-15N]-Gly,Ser S100A11		2.0 mM

11 HCCH-TOCSY

Instrument

#1 Model Varian UNITY (500 MHz)

#2 Model Varian INOVA (600 MHz)

#3 Model Varian INOVA (800 MHz)

Sample #1

Temperature 308 (±0.1) K, pH 7.25 (±0.01)

#	Name	Isotope labeling	Type	Concentration
1	S100A11	[U-15N; U-13C]		2.0 mM

Sample #2

Temperature 308 (±0.1) K, pH 7.25 (±0.01)

#	Name	Isotope labeling	Type	Concentration
2	S100A11	[U-15N]-Gly,Ser S100A11		2.0 mM

nullKeywords apo-S100A11, resonance assignments

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Found 1 Document (2.466 seconds)

BMRB: 5189

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Chemical shift reference

Related entities 1. S100A11 homodimer, : 1 : 1 : 240 entities Detail

Interaction partners 1. S100A11 homodimer, : 15 interactors Detail

Experiments performed 11 experiments Detail

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