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BMRB: 15632

2JZY

Solution structure of C-terminal effector domain of putative two-component-system response regulator involved in copper resistance from Klebsiella pneumoniae

Authors

Hung, K., Fang, P., Chang, C., Tsai, S., Huang, T.

Assembly

TCS C-domain

Entity

1. TCS C-domain (polymer, Thiol state: all free), 112 monomers, 12908.77 Da Detail

MAATVCTIAD MTVDMVRRTV IRSGKKIHLT GKEYVLLELL LQRTGEVLPR SLISSLVWNM NFDSDTNVID VAVRRLRSKI DDDFEPKLIH TVRGAGYVLE IREELEHHHH HH

Formula weight

12908.77 Da

Source organism

Klebsiella pneumoniae

Exptl. method

solution NMR

Refine. method

distance geometry, simulated annealing, torsion angle dynamics

Data set

assigned_chemical_shifts, spectral_peak_list

Chem. Shift Complete

Sequence coverage: 91.1 %, Completeness: 77.8 %, Completeness (bb): 87.6 % Detail

Polymer type: polypeptide(L)

	Total	¹H	¹³C	¹⁵N
All	77.8 % (1022 of 1313)	75.8 % (513 of 677)	78.7 % (410 of 521)	86.1 % (99 of 115)
Backbone	87.6 % (585 of 668)	87.7 % (199 of 227)	87.9 % (291 of 331)	86.4 % (95 of 110)
Sidechain	70.9 % (533 of 752)	69.8 % (314 of 450)	72.4 % (215 of 297)	80.0 % (4 of 5)
Aromatic	0.0 % (0 of 80)	0.0 % (0 of 40)	0.0 % (0 of 39)	0.0 % (0 of 1)
Methyl	93.7 % (148 of 158)	94.9 % (75 of 79)	92.4 % (73 of 79)

1. TCS C-domain

MAATVCTIAD MTVDMVRRTV IRSGKKIHLT GKEYVLLELL LQRTGEVLPR SLISSLVWNM NFDSDTNVID VAVRRLRSKI DDDFEPKLIH TVRGAGYVLE IREELEHHHH HH

Show sample condition

Sample

Solvent system 90% H2O/10% D2O, Pressure 1 atm, Temperature 293 K, pH 7.5

#	Name	Isotope labeling	Concentration
1	C-terminal domain of TCS response regulator	[U-13C; U-15N]	1 mM
2	Tris	natural abundance	20 mM
3	NaCl	natural abundance	150 mM
4	Glu	natural abundance	150 mM
5	Arg	natural abundance	150 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: 0.22 ppm, Outliers: 1 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: 0.22 ppm, Outliers: 1 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: -0.04 ppm, Outliers: 1 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: 0.36 ppm, Outliers: 2 Detail

Protein Blocks Logo

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

Release date

2014-03-04

Citation

Solution structure of C-terminal effector domain of putative two-component-system response regulator involved in copper resistance from Klebsiella pneumoniae
Hung, K., Fang, P., Lin, Y., Chang, C., Tsai, S., Huang, T.

Related entities 1. TCS C-domain, : 1 : 1 : 167 entities Detail

Experiments performed 10 experiments Detail

1 3D HNCA