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MolNFT v1 · #27266 · protein

High resolution crystal structure of escherichia COLI iron- peptide deformylase bound to formate

1XEN: “High resolution crystal structure of escherichia COLI iron- peptide deformylase bound to formate”. X-ray diffraction, 1 ligand (FE), 1 pocket (best druggability 0.49). MolNFT v1 #27266 on GenesisL1: 3D structure, binding sites and…

PDB
1XEN
Type
protein
Length
165 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Peptide deformylase
EC
3.5.1.88
UniProt
P0A6K3
Ligands
FE
Pockets
1 · best druggability 0.49

Structure

x-ray diffraction · 1 distinct chain · 36% helix, 24% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
APeptide deformylase (EC 3.5.1.88)protein16536% helix, 24% strandP0A6K3

Ligands and binding sites

  • FE · Fe (III) ion · metal · chains A
  • FMT · Formic acid · additive · 6 copies · 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, 0 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11150.490.8118FE, FMT

Compared structures

  • 1XEN · High Resolution Crystal Structure of Escherichia coli Iron- Peptide Deformylase Bound To… · the same entry in another collection · chain A against A, TM-score 1.00
  • P0A6K3 · AlphaFold monomer V2.0 prediction for peptide deformylase (P0A6K3) · a predicted model of the same protein · chain A against A, TM-score 0.99

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