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MolNFT v1 · #100436 · protein

X-ray structure of FE(II)-ZNPIXFEBMB1

4MXK · Myoglobin: “X-ray structure of FE(II)-ZNPIXFEBMB1”. X-ray diffraction, 2 ligands (ZNH, FE2), 1 pocket (best druggability 0.70). MolNFT v1 #100436 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
4MXK
Type
protein
Length
153 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Myoglobin
UniProt
P02185
Ligands
ZNH, FE2
Pockets
1 · best druggability 0.70

Structure

x-ray diffraction · 1 distinct chain · 78% helix, 0% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AMyoglobinprotein15378% helix, 0% strandP02185

Ligands and binding sites

  • ZNH · Protoporphyrin IX containing Zn · ligand · chains A
  • FE2 · Fe (II) ion · metal · 2 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, 1 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
12260.700.8628ZNH

Compared structures

  • 4MXK · X-ray structure of Fe(II)-ZnPIXFeBMb1 · the same entry in another collection · chain A against A, TM-score 1.00

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