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MolNFT v1 · #137705 · protein

Ligand free structure of cytochrome P450 TBTJ1

5VWS: “Ligand free structure of cytochrome P450 TBTJ1”. X-ray diffraction, 1 ligand (HEM), 1 pocket (best druggability 0.80). MolNFT v1 #137705 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
5VWS
Type
protein
Length
376 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Cytochrome P450
UniProt
D6Y4Z8
Ligands
HEM
Pockets
1 · best druggability 0.80

Structure

x-ray diffraction · 1 distinct chain · 55% helix, 11% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ACytochrome P450protein37655% helix, 11% strandD6Y4Z8

Ligands and binding sites

  • HEM · Protoporphyrin IX containing Fe · 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
17580.800.8463HEM

Compared structures

  • 5VWS · Ligand free structure of Cytochrome P450 TbtJ1 · the same entry in another collection · chain A against A, TM-score 1.00

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