MolNFT v1 · #76794 · protein

Allantoin racemase from klebsiella pneumoniae

3QVL · Putative hydantoin racemase: “Allantoin racemase from klebsiella pneumoniae”. X-ray diffraction, 1 ligand (5HY), 9 pockets (best druggability 0.73). MolNFT v1 #76794 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB: 3QVL
Type: protein
Length: 490 residues
Chains: 2
Method: x-ray diffraction
Collection: MolNFT v1 / PDB
Contract: 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner: 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule: Putative hydantoin racemase
UniProt: A6T9E8
Ligands: 5HY
Pockets: 9 · best druggability 0.73

Structure

x-ray diffraction · 1 distinct chain · 50% helix, 15% strand (DSSP).

Chain	Molecule	Type	Residues	Secondary structure	UniProt
A, B	Putative hydantoin racemase	protein	245	50% helix, 15% strand	A6T9E8

Ligands and binding sites

5HY · [(4R)-2,5-dioxoimidazolidin-4-yl]acetic acid · ligand · 2 copies · chains A, B

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

Pockets

9 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	71	0.73	0.98	23	5HY
2	50	0.70	0.98	25	5HY
3	100	0.44	0.79	22	empty
4	70	0.34	0.76	11	empty
5	84	0.33	0.74	18	empty

Interfaces

1 interface between chains.

A–B · 501 Å² buried · 4 hydrogen bonds · protein-protein

Compared structures

3QVL · Allantoin racemase from Klebsiella pneumoniae · 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 A6T9E8
Elsewhere: RCSB PDB 3QVL · PDBe 3QVL · UniProt A6T9E8

GL1X is a live explorer of the GenesisL1 blockchain. Turn on JavaScript for search, charts and interactive views.