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MolNFT v1 · #127485 · protein

KUSTC0563 C-type cytochrome

5MXY · Cytochrome C-552 KS_3358: “KUSTC0563 C-type cytochrome”. X-ray diffraction, 2 ligands (HEC, ZN), 1 pocket (best druggability 0.66). MolNFT v1 #127485 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
5MXY
Type
protein
Length
83 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Cytochrome C-552 KS_3358
UniProt
Q30JB5
Ligands
HEC, ZN
Pockets
1 · best druggability 0.66

Structure

x-ray diffraction · 1 distinct chain · 55% helix, 2% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ACytochrome C-552 KS_3358protein8355% helix, 2% strandQ30JB5

Ligands and binding sites

  • HEC · Heme C · ligand · chains A
  • ZN · Zinc ion · metal · 10 copies · chains A
  • EDO · 1,2-ethanediol · additive · chains A
  • ACT · Acetate ion · additive · 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
12300.660.8328HEC

Modifications

Observed in the structure: 2 cofactor (heme c attachment).

Compared structures

  • 5MXY · KustC0563 c-type cytochrome · the same entry in another collection · chain A against A, TM-score 1.00

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