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BMRB: 15743

2KP5

Sequence specific 1H, 13C and 15N resonance assignment of Hahellin from Hahella chejuensis, a putative member of the bg-crystallin superfamily

Authors

Srivastava, A.KUMAR., Chary, K.VENKAT RAMAN., Sharma, Y.

Assembly

Hahellin

Entity

1. hahellin (polymer, Thiol state: not present), 92 monomers, 10249.18 Da Detail

MGEKTVKLYE DTHFKGYSVE LPVGDYNLSS LISRGALNDD LSSARVPSGL RLEVFQHNNF KGVRDFYTSD AAELSRDNDA SSVRVSKMET TN

2. CA (non-polymer), 40.078 Da

Total weight

10289.258 Da

Max. entity weight

10249.18 Da

Source organism

Hahella chejuensis

Exptl. method

solution NMR

Refine. method

simulated annealing, torsion angle dynamics

Data set

assigned_chemical_shifts

Chem. Shift Complete

Sequence coverage: 96.7 %, Completeness: 87.3 %, Completeness (bb): 96.4 % Detail

Polymer type: polypeptide(L)

	Total	¹H	¹³C	¹⁵N
All	87.3 % (904 of 1035)	87.1 % (466 of 535)	85.9 % (346 of 403)	94.8 % (92 of 97)
Backbone	96.4 % (528 of 548)	96.3 % (181 of 188)	96.3 % (260 of 270)	96.7 % (87 of 90)
Sidechain	80.3 % (460 of 573)	82.1 % (285 of 347)	77.6 % (170 of 219)	71.4 % (5 of 7)
Aromatic	2.5 % (2 of 80)	2.5 % (1 of 40)	2.5 % (1 of 40)
Methyl	95.7 % (88 of 92)	100.0 % (46 of 46)	91.3 % (42 of 46)

1. hahellin

MGEKTVKLYE DTHFKGYSVE LPVGDYNLSS LISRGALNDD LSSARVPSGL RLEVFQHNNF KGVRDFYTSD AAELSRDNDA SSVRVSKMET TN

Show sample condition

Sample

Solvent system 93% H2O/7% D2O, Pressure 1 atm, Temperature 298 K, pH 6.7

#	Name	Isotope labeling	Concentration
1	sodium chloride	natural abundance	0.8 mM
2	sodium chloride	natural abundance	300 mM
3	Tris.Cl	natural abundance	10 mM
4	calcium chloride	natural abundance	20 mM

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: 0.01 ppm, Outliers: 3 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: 0.01 ppm, Outliers: 3 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: 0.03 ppm, Outliers: 3 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: 0.91 ppm, Outliers: 1 Detail

Protein Blocks Logo

Calculated from 20 models in PDB: 2KP5, Strand ID: A Detail

Release date

2008-09-11

Citation

Sequence specific 1H, 13C, and 15N resonance assignments of Hahellin from Hahella chejuensis, a putative member of the betagamma-crystallin superfamily
Srivastava, A.K., Sharma, Y., Chary, K.V.R.
Biomol. NMR Assign. (2008), 2, 151-153, PubMed 19636892 , DOI 10.1007/s12104-008-9108-6 , Abstract

Related entities 1. hahellin, : 1 : 25 entities Detail

Experiments performed 9 experiments Detail

1 2D 1H-15N HSQC