MolNFT v1 · #37062 · protein

Secreted chorismate mutase from mycobacterium tuberculosis

2FP2: “Secreted chorismate mutase from mycobacterium tuberculosis”. X-ray diffraction, 1 ligand (TSA), 3 pockets (best druggability 0.72). MolNFT v1 #37062 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB: 2FP2
Type: protein
Length: 325 residues
Chains: 2
Method: x-ray diffraction
Collection: MolNFT v1 / PDB
Contract: 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner: 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule: Chorismate mutase
EC: 5.4.99.5
UniProt: O07746
Ligands: TSA
Pockets: 3 · best druggability 0.72

Structure

x-ray diffraction · 2 distinct chains · 75% helix, 0% strand (DSSP).

Chain	Molecule	Type	Residues	Secondary structure	UniProt
A	Chorismate mutase (EC 5.4.99.5)	protein	162	75% helix, 0% strand	O07746
B	Chorismate mutase (EC 5.4.99.5)	protein	163	76% helix, 0% strand	O07746

Ligands and binding sites

TSA · 8-hydroxy-2-oxa-bicyclo[3.3.1]non-6-ene-3,5-dicarboxylic acid · ligand · chains B

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

Pockets

3 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	72	0.72	0.96	16	TSA
2	211	0.61	0.82	24	empty
3	168	0.44	0.74	30	empty

Interfaces

1 interface between chains.

A–B · 834 Å² buried · 14 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 2 disulfide (disulfide).

Compared structures

2FP2 · Secreted Chorismate Mutase from Mycobacterium tuberculosis · 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 O07746
Elsewhere: RCSB PDB 2FP2 · PDBe 2FP2 · UniProt O07746

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