MolNFT v1 · #91340 · protein

Crystal structure of the salicylate 1,2-dioxygenase from pseudoaminobacter salicylatoxidans A85H mutant

4FAH · Gentisate 1,2-dioxygenase: “Crystal structure of the salicylate 1,2-dioxygenase from pseudoaminobacter salicylatoxidans A85H mutant”. X-ray diffraction, 1 ligand (FE), 6 pockets (best druggability 0.57). MolNFT v1 #91340 on…

PDB: 4FAH
Type: protein
Length: 350 residues
Chains: 1
Method: x-ray diffraction
Collection: MolNFT v1 / PDB
Contract: 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner: 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule: Gentisate 1,2-dioxygenase
EC: 1.13.11.4
UniProt: Q67FT0
Ligands: FE
Pockets: 6 · best druggability 0.57

Structure

x-ray diffraction · 1 distinct chain · 20% helix, 34% strand (DSSP).

Chain	Molecule	Type	Residues	Secondary structure	UniProt
A	Gentisate 1,2-dioxygenase (EC 1.13.11.4)	protein	350	20% helix, 34% strand	Q67FT0

Ligands and binding sites

FE · Fe (III) ion · metal · chains A

Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.

Pockets

6 pockets found on a 1 Å grid, 2 with a druggability of 0.5 or more.

Pocket	Volume (Å³)	Druggability	Buriedness	Lining residues	Inside
1	263	0.57	0.78	29	FE
2	152	0.53	0.80	36	empty
3	191	0.46	0.74	21	empty
4	112	0.43	0.78	18	empty
5	131	0.41	0.74	24	empty

Compared structures

4FAH · Crystal Structure of the Salicylate 1,2-dioxygenase from Pseudoaminobacter… · 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 Q67FT0
Elsewhere: RCSB PDB 4FAH · PDBe 4FAH · UniProt Q67FT0

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