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MolNFT v1 · #59432 · protein

Ppcb, a cytochrome C7 from geobacter sulfurreducens

3BXU · Cytochrome C3: “Ppcb, a cytochrome C7 from geobacter sulfurreducens”. X-ray diffraction, 2 ligands (HEM, SO4), 1 pocket (best druggability 0.78). MolNFT v1 #59432 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
3BXU
Type
protein
Length
142 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Cytochrome C3
UniProt
Q74G83
Ligands
HEM, SO4
Pockets
1 · best druggability 0.78

Structure

x-ray diffraction · 1 distinct chain · 38% helix, 15% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, BCytochrome C3protein7138% helix, 15% strandQ74G83

Ligands and binding sites

  • HEM · Protoporphyrin IX containing Fe · ligand · 6 copies · chains A, B
  • SO4 · Sulfate ion · ion · 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
19090.780.8197HEM

Interfaces

1 interface between chains.

  • A–B · 571 Ų buried · 12 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 12 cofactor (heme attachment).

Compared structures

  • 3BXU · PpcB, A Cytochrome c7 from Geobacter sulfurreducens · the same entry in another collection · chain A against A, TM-score 1.00

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