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M.ACETIVORANS protoglobin F145W mutant

Analyse M.ACETIVORANS protoglobin F145W mutant in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
3ZOM
Type
protein
Length
382 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Protoglobin
UniProt
Q8TLY9
Ligands
HEM, SO4
Pockets
3 · best druggability 0.85

Structure

x-ray diffraction · 1 distinct chain · 63% helix, 1% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, BProtoglobinprotein19163% helix, 1% strandQ8TLY9

Ligands and binding sites

  • HEM · Protoporphyrin IX containing Fe · ligand · 2 copies · chains A, B
  • SO4 · Sulfate ion · ion · chains A
  • GOL · Glycerol · additive · 3 copies · chains B, A

Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.

Pockets

3 pockets found on a 1 Å grid, 2 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
12830.850.9637HEM
22910.850.9536HEM
3560.450.8416GOL

Interfaces

1 interface between chains.

  • A–B · 337 Ų buried · 1 hydrogen bond · protein-protein

Compared structures

  • 3ZOM · M.acetivorans protoglobin F145W mutant · the same entry in another collection · chain A against A, TM-score 1.00

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