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MolNFT v1 · #25851 · protein

Crystal structure of human kynurenine aminotransferase I

1W7L · Kynurenine--oxoglutarate transaminase I: “Crystal structure of human kynurenine aminotransferase I”. X-ray diffraction, 1 ligand (PLP), 4 pockets (best druggability 0.63). MolNFT v1 #25851 on GenesisL1: 3D structure, binding sites…

PDB
1W7L
Type
protein
Length
415 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Kynurenine--oxoglutarate transaminase I
EC
4.4.1.13
UniProt
Q16773
Ligands
PLP
Pockets
4 · best druggability 0.63

Structure

x-ray diffraction · 1 distinct chain · 47% helix, 16% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AKynurenine--oxoglutarate transaminase I (EC 4.4.1.13)protein41547% helix, 16% strandQ16773

Ligands and binding sites

  • PLP · Pyridoxal-5'-phosphate · ligand · 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
12370.630.8139PLP
21910.490.7621empty
31420.450.7621empty
4500.270.7414empty

Modifications

Observed in the structure: 1 cofactor (pyridoxal phosphate Schiff base).

Compared structures

  • 1W7L · Crystal structure of human kynurenine aminotransferase I · the same entry in another collection · chain A against A, TM-score 1.00
  • Q16773 · AlphaFold monomer V2.0 prediction for kynurenine--oxoglutarate transaminase 1 (Q16773) · a predicted model of the same protein · chain A against A, TM-score 1.00

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