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MolNFT v1 · #140931 · protein

Human methionine aminopeptidase type 1B (F309L mutant) in complex with ovalicin

5YR5 · Methionine aminopeptidase 1: “Human methionine aminopeptidase type 1B (F309L mutant) in complex with ovalicin”. X-ray diffraction, 3 ligands (OVA, CO, NA), 1 pocket (best druggability 0.65). MolNFT v1 #140931 on GenesisL1: 3D…

PDB
5YR5
Type
protein
Length
304 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Methionine aminopeptidase 1
EC
3.4.11.18
UniProt
P53582
Ligands
OVA, CO, NA
Pockets
1 · best druggability 0.65

Structure

x-ray diffraction · 1 distinct chain · 27% helix, 23% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AMethionine aminopeptidase 1 (EC 3.4.11.18)protein30427% helix, 23% strandP53582

Ligands and binding sites

  • OVA · 3,4-dihydroxy-2-methoxy-4-methyl-3-[2-methyl-3-(3-methyl-but-2-enyl) -oxiranyl]-cyclohexanone · ligand · chains A
  • CO · Cobalt (II) ion · metal · 3 copies · chains A
  • NA · Sodium ion · metal · 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, 1 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
12900.650.8142CO, OVA

Modifications

Observed in the structure: 1 covalent (covalent ligand).

Compared structures

  • 5YR5 · Human methionine aminopeptidase type 1b (F309L mutant) in complex with Ovalicin · the same entry in another collection · chain A against A, TM-score 1.00
  • P53582 · AlphaFold monomer V2.0 prediction for methionine aminopeptidase 1 (P53582) · a predicted model of the same protein · chain A against A, TM-score 1.00

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