MolNFT v1 · #172546 · protein

Structure of D172N blac from mycobacterium tuberculosis

7A5W · Beta-lactamase: “Structure of D172N blac from mycobacterium tuberculosis”. X-ray diffraction, 1 pocket (best druggability 0.33). MolNFT v1 #172546 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB: 7A5W
Type: protein
Length: 266 residues
Chains: 1
Method: x-ray diffraction
Collection: MolNFT v1 / PDB
Contract: 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner: 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule: Beta-lactamase
EC: 3.5.2.6
UniProt: A0A655AHQ9
Pockets: 1 · best druggability 0.33

Structure

x-ray diffraction · 1 distinct chain · 45% helix, 17% strand (DSSP).

Chain	Molecule	Type	Residues	Secondary structure	UniProt
A	Beta-lactamase (EC 3.5.2.6)	protein	266	45% helix, 17% strand	A0A655AHQ9

Ligands and binding sites

EDO · 1,2-ethanediol · additive · 5 copies · chains A

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

Pockets

1 pocket found on a 1 Å grid, 0 with a druggability of 0.5 or more.

Pocket	Volume (Å³)	Druggability	Buriedness	Lining residues	Inside
1	97	0.33	0.74	18	empty

Modifications

Observed in the structure: 1 modified (oxidation).

Compared structures

7A5W · Structure of D172N BlaC 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 A0A655AHQ9
Elsewhere: RCSB PDB 7A5W · PDBe 7A5W · UniProt A0A655AHQ9

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