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BMRB: 15810

2K4V

Solution structure of uncharacterized protein PA1076 from Pseudomonas aeruginosa. Northeast Structural Genomics Consortium (NESG) target PaT3, Ontario Center for Structural Proteomics target PA1076.

Authors

Gutmanas, A., Lemak, A., Fares, C., Yee, A., Semesi, A., Arrowsmith, C.H.

Assembly

PA1076

Entity

1. PA1076 (polymer, Thiol state: not present), 125 monomers, 14209.62 Da Detail

QGHMFEPGHL HLVSLPGLDQ QDINIHIRYE VRQNAESGAY VHFDMDGEID GKPFSDSFEL PRDTAFNFAS DATRVAQKHG LHPKFGAITR VHKEYDAMFE DIRAKLHAHP GEPVDLERII RHEGS

Formula weight

14209.62 Da

Source organism

Pseudomonas aeruginosa

Exptl. method

solution NMR

Refine. method

simulated annealing

Data set

assigned_chemical_shifts

Chem. Shift Complete

Sequence coverage: 99.2 %, Completeness: 89.6 %, Completeness (bb): 89.0 % Detail

Polymer type: polypeptide(L)

	Total	¹H	¹³C	¹⁵N
All	89.6 % (1298 of 1448)	91.0 % (686 of 754)	89.6 % (509 of 568)	81.7 % (103 of 126)
Backbone	89.0 % (655 of 736)	90.5 % (229 of 253)	90.1 % (329 of 365)	82.2 % (97 of 118)
Sidechain	91.1 % (753 of 827)	91.2 % (457 of 501)	91.2 % (290 of 318)	75.0 % (6 of 8)
Aromatic	71.6 % (106 of 148)	75.7 % (56 of 74)	67.6 % (50 of 74)
Methyl	98.2 % (112 of 114)	98.2 % (56 of 57)	98.2 % (56 of 57)

1. PA1076

QGHMFEPGHL HLVSLPGLDQ QDINIHIRYE VRQNAESGAY VHFDMDGEID GKPFSDSFEL PRDTAFNFAS DATRVAQKHG LHPKFGAITR VHKEYDAMFE DIRAKLHAHP GEPVDLERII RHEGS

Show sample condition

Sample

Solvent system 90% H2O/10% D2O, Pressure 1 atm, Temperature 298 K, pH 7

#	Name	Isotope labeling	Concentration
1	PA1076	[U-100% 13C; U-100% 15N]	0.7-1 mM
2	TRIS	[U-2H]	10 mM
3	sodium chloride	natural abundance	300 mM
4	sodium azide	natural abundance	0.01 %
5	benzamidine	natural abundance	1 mM
6	inhibitor cocktail	natural abundance	1 na

LACS Plot; CA

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

Referencing offset: -1.08 ppm, Outliers: 4 Detail

LACS Plot; CB

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

Referencing offset: -1.08 ppm, Outliers: 4 Detail

LACS Plot; HA

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

Referencing offset: 0.0 ppm, Outliers: 4 Detail

LACS Plot; CO

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

Referencing offset: 0.23 ppm, Outliers: 2 Detail

Protein Blocks Logo

Calculated from 20 models in PDB: 2K4V, Strand ID: A Detail

Release date

2009-04-22

Citation

Solution structure of uncharacterized protein PA1076 from Pseudomonas aeruginosa
Gutmanas, A., Lemak, A., Fares, C., Yee, A., Semesi, A., Arrowsmith, C.H.
Not known

Related entities 1. PA1076, : 1 entities Detail

Experiments performed 18 experiments Detail

1 2D 1H-15N HSQC