MolNFT v1 · #94743 · protein

Structure and function of sensor histidine kinase

4I5S · Putative histidine kinase covs: “Structure and function of sensor histidine kinase”. X-ray diffraction, 10 pockets (best druggability 0.63). MolNFT v1 #94743 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB: 4I5S
Type: protein
Length: 775 residues
Chains: 2
Method: x-ray diffraction
Collection: MolNFT v1 / PDB
Contract: 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner: 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule: Putative histidine kinase covs
EC: 2.7.13.1
UniProt: Q8DT64
Pockets: 10 · best druggability 0.63

Structure

x-ray diffraction · 2 distinct chains · 46% helix, 19% strand (DSSP).

Chain	Molecule	Type	Residues	Secondary structure	UniProt
A	Putative histidine kinase covs (EC 2.7.13.1)	protein	380	46% helix, 20% strand	Q8DT64
B	Putative histidine kinase covs (EC 2.7.13.1)	protein	395	46% helix, 18% strand	Q8DT64

Pockets

10 pockets found on a 1 Å grid, 8 with a druggability of 0.5 or more.

Pocket	Volume (Å³)	Druggability	Buriedness	Lining residues	Inside
1	133	0.63	0.86	32	empty
2	126	0.62	0.86	27	empty
3	78	0.59	0.89	22	empty
4	219	0.58	0.79	32	empty
5	99	0.55	0.85	23	empty

Interfaces

1 interface between chains.

A–B · 4126 Å² buried · 24 hydrogen bonds · protein-protein

Compared structures

4I5S · Structure and function of sensor histidine kinase · 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 Q8DT64
Elsewhere: RCSB PDB 4I5S · PDBe 4I5S · UniProt Q8DT64

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