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MolNFT v1 · #153044 · protein

Crystal structure of ribose-5-phosphate isomerase a from ochrobactrum sp. CSL1

6J1K: “Crystal structure of ribose-5-phosphate isomerase a from ochrobactrum sp. CSL1”. X-ray diffraction, 4 pockets (best druggability 0.63). MolNFT v1 #153044 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
6J1K
Type
protein
Length
456 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Ribose-5-phosphate isomerase a
Pockets
4 · best druggability 0.63

Structure

x-ray diffraction · 2 distinct chains · 30% helix, 27% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ARibose-5-phosphate isomerase aprotein23031% helix, 24% strand—
BRibose-5-phosphate isomerase aprotein22630% helix, 29% strand—

Ligands and binding sites

  • PEG · Di(hydroxyethyl)ether · additive · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
14320.630.7764empty
2570.380.8025empty
3550.380.8120PEG
4510.350.7916empty

Interfaces

1 interface between chains.

  • A–B · 1169 Ų buried · 4 hydrogen bonds · protein-protein

Compared structures

  • 6J1K · Crystal structure of ribose-5-phosphate isomerase A from Ochrobactrum sp. CSL1 · the same entry in another collection · chain A against A, TM-score 1.00

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