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MolNFT v1 · #66202 · protein

Crystal structure of putative alpha-ribazole-5'-phosphate phosphatase cobc from vibrio parahaemolyticus

3HJG: “Crystal structure of putative alpha-ribazole-5'-phosphate phosphatase cobc from vibrio parahaemolyticus”. X-ray diffraction, 1 ligand (SO4), 2 pockets (best druggability 0.70). MolNFT v1 #66202 on GenesisL1: 3D structure, binding…

PDB
3HJG
Type
protein
Length
404 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Putative alpha-ribazole-5'-phosphate phosphatase cobc
UniProt
Q87Q43
Ligands
SO4
Pockets
2 · best druggability 0.70

Structure

x-ray diffraction · 1 distinct chain · 38% helix, 19% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, BPutative alpha-ribazole-5'-phosphate phosphatase cobcprotein20238% helix, 19% strandQ87Q43

Ligands and binding sites

  • SO4 · Sulfate ion · ion · 4 copies · chains A, B

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
15570.700.7962SO4
21070.480.8020SO4

Interfaces

1 interface between chains.

  • A–B · 794 Ų buried · 16 hydrogen bonds · protein-protein

Compared structures

  • 3HJG · Crystal structure of putative alpha-ribazole-5'-phosphate phosphatase CobC FROM Vibrio… · the same entry in another collection · chain A against A, TM-score 1.00

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