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MolNFT v1 · #10490 · protein

Solution structures of ferrocytochrome C3 from desulfovibrio vulgaris miyazaki F

1IT1: “Solution structures of ferrocytochrome C3 from desulfovibrio vulgaris miyazaki F”. Solution nmr, 1 ligand (HEC), 1 pocket (best druggability 0.76). MolNFT v1 #10490 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
1IT1
Type
protein
Length
107 residues
Chains
1
Method
solution nmr
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Cytochrome C3
UniProt
P00132
Ligands
HEC
Pockets
1 · best druggability 0.76

Structure

solution nmr · 1 distinct chain · 25% helix, 9% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ACytochrome C3protein10725% helix, 9% strandP00132

Ligands and binding sites

  • HEC · Heme C · ligand · 4 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
14540.760.8561HEC

Modifications

Observed in the structure: 8 cofactor (heme c attachment).

Compared structures

  • 1IT1 · Solution structures of ferrocytochrome c3 from Desulfovibrio vulgaris Miyazaki F · the same entry in another collection · chain A against A, TM-score 1.00
  • P00132 · AlphaFold monomer V2.0 prediction for cytochrome C3 (P00132) · a predicted model of the same protein · chain A against A, TM-score 0.91

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