MolNFT v1 · #82031 · protein

Crystal structure of the extracellular domain of the putative hybrid two component system BT4673 from B. thetaiotaomicron

3VA6 · Two-component system sensor histidine kinase: “Crystal structure of the extracellular domain of the putative hybrid two component system BT4673 from B.…”. X-ray diffraction, 16 pockets (best druggability 0.81). MolNFT v1 #82031 on…

PDB: 3VA6
Type: protein
Length: 1,490 residues
Chains: 2
Method: x-ray diffraction
Collection: MolNFT v1 / PDB
Contract: 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner: 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule: Two-component system sensor histidine kinase
UniProt: Q89YQ8
Pockets: 16 · best druggability 0.81

Structure

x-ray diffraction · 2 distinct chains · 3% helix, 47% strand (DSSP).

Chain	Molecule	Type	Residues	Secondary structure	UniProt
A	Two-component system sensor histidine kinase	protein	747	3% helix, 47% strand	Q89YQ8
B	Two-component system sensor histidine kinase	protein	743	2% helix, 48% strand	Q89YQ8

Pockets

16 pockets found on a 1 Å grid, 10 with a druggability of 0.5 or more.

Pocket	Volume (Å³)	Druggability	Buriedness	Lining residues	Inside
1	1064	0.81	0.82	89	empty
2	1087	0.80	0.82	86	empty
3	1127	0.73	0.77	95	empty
4	919	0.73	0.77	66	empty
5	751	0.72	0.78	47	empty

Interfaces

1 interface between chains.

A–B · 2232 Å² buried · 36 hydrogen bonds · protein-protein

Compared structures

3VA6 · Crystal Structure of the extracellular domain of the putative hybrid two component system… · the same entry in another collection · chain A against A, TM-score 1.00

Analyse

Open in the research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides and crosslinks on the 3D structure
Every structure of UniProt Q89YQ8
Elsewhere: RCSB PDB 3VA6 · PDBe 3VA6 · UniProt Q89YQ8

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