BMRB: 15688

Automated NMR Structure of the TA0956 by FAPSY

Authors

Lee, W., Jung, J., Lee, W.

Assembly

TA0956

Entity

1. TA0956 (polymer, Thiol state: unknown), 110 monomers, 12558.39 Da Detail

MTLCAMYNIS MAGSHPTTIC VVMDRFLESF SELYDIIDEN DTDVMMDFIS RFARTDEIMP EDKTVGFVVV NADKKLMSVS FSDIDENMKK VIKATAEKFK NKGFKVETDM

Formula weight

12558.39 Da

Source organism

Thermoplasma acidophilum

Exptl. method

solution NMR

Refine. method

simulated annealing

Data set

assigned_chemical_shifts

Chem. Shift Complete

Sequence coverage: 100.0 %, Completeness: 78.1 %, Completeness (bb): 84.8 % Detail

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Polymer type: polypeptide(L)

	Total	1H	13C	15N
All	78.1 % (1005 of 1286)	85.1 % (565 of 664)	64.8 % (330 of 509)	97.3 % (110 of 113)
Backbone	84.8 % (556 of 656)	96.4 % (213 of 221)	71.9 % (235 of 327)	100.0 % (108 of 108)
Sidechain	75.4 % (556 of 737)	79.5 % (352 of 443)	69.9 % (202 of 289)	40.0 % (2 of 5)
Aromatic	34.0 % (34 of 100)	68.0 % (34 of 50)	0.0 % (0 of 50)
Methyl	97.4 % (113 of 116)	98.3 % (57 of 58)	96.6 % (56 of 58)

1. TA0956

MTLCAMYNIS MAGSHPTTIC VVMDRFLESF SELYDIIDEN DTDVMMDFIS RFARTDEIMP EDKTVGFVVV NADKKLMSVS FSDIDENMKK VIKATAEKFK NKGFKVETDM

Show sample condition

Sample

Solvent system 90% H2O/10% D2O, Pressure 1 atm, Temperature 298 K, pH 6.5

#	Name	Isotope labeling	Type	Concentration
1	TA0956	[U-98% 13C; U-98% 15N]		1.5 mM

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LACS Plot; CA

Referencing offset: 0.24 ppm, Outliers: 1 Detail

Show chemical shift referencing parameters

Chemical shift reference

Atom type	Mol. common name	Atom group	Value	Ref. method	Ref. type	Shift ratio
13C	DSS	methyl protons	0.0 ppm	null	indirect	0.2514495
1H	DSS	methyl protons	0.0 ppm	internal	direct	1.0
15N	DSS	methyl protons	0.0 ppm	null	indirect	0.1013291

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LACS Plot; CB

Referencing offset: 0.24 ppm, Outliers: 1 Detail

Show chemical shift referencing parameters

Chemical shift reference

Atom type	Mol. common name	Atom group	Value	Ref. method	Ref. type	Shift ratio
13C	DSS	methyl protons	0.0 ppm	null	indirect	0.2514495
1H	DSS	methyl protons	0.0 ppm	internal	direct	1.0
15N	DSS	methyl protons	0.0 ppm	null	indirect	0.1013291

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LACS Plot; HA

Referencing offset: -0.06 ppm, Outliers: 1 Detail

Show chemical shift referencing parameters

Chemical shift reference

Atom type	Mol. common name	Atom group	Value	Ref. method	Ref. type	Shift ratio
13C	DSS	methyl protons	0.0 ppm	null	indirect	0.2514495
1H	DSS	methyl protons	0.0 ppm	internal	direct	1.0
15N	DSS	methyl protons	0.0 ppm	null	indirect	0.1013291

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Protein Blocks Logo

Calculated from 20 models in PDB: 2K24, Strand ID: A Detail

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Release date

2012-08-13

Citation

The Automated Suite for Protein Structure by NMR Spectroscopy
Lee, W., Jung, J., Lee, W.

Related entities 1. TA0956, : 1 : 1 entities Detail

Experiments performed 9 experiments Detail