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MolNFT v1 · #4655 · protein

Sperm whale metaquomyoglobin proximal histidine mutant H93G with 1- methylimidazole as proximal ligand.

1DUO · Sperm whale metaquomyoglobin variant H93G: “Sperm whale metaquomyoglobin proximal histidine mutant H93G with 1- methylimidazole as proximal ligand.”. X-ray diffraction, 2 ligands (HEM, 1MZ), 1 pocket (best druggability 0.73). MolNFT…

PDB
1DUO
Type
protein
Length
152 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Sperm whale metaquomyoglobin variant H93G
UniProt
P02185
Ligands
HEM, 1MZ
Pockets
1 · best druggability 0.73

Structure

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

ChainMoleculeTypeResiduesSecondary structureUniProt
ASperm whale metaquomyoglobin variant H93Gprotein15278% helix, 0% strandP02185

Ligands and binding sites

  • HEM · Protoporphyrin IX containing Fe · ligand · chains A
  • 1MZ · 1-methylimidazole · ligand · 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
13170.730.8431HEM, 1MZ

Compared structures

  • 1DUO · Sperm whale metaquomyoglobin proximal histidine mutant H93G with 1-methylimidazole as… · the same entry in another collection · chain A against A, TM-score 1.00

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