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MolNFT v1 · #114430 · protein

Ent-copalyl diphosphate synthase from streptomyces platensis

5BP8: “Ent-copalyl diphosphate synthase from streptomyces platensis”. X-ray diffraction, 1 ligand (SO4), 5 pockets (best druggability 0.78). MolNFT v1 #114430 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
5BP8
Type
protein
Length
515 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Ent-copalyl diphosphate synthase
UniProt
A0A023VSF1
Ligands
SO4
Pockets
5 · best druggability 0.78

Structure

x-ray diffraction · 1 distinct chain · 57% helix, 3% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AEnt-copalyl diphosphate synthaseprotein51557% helix, 3% strandA0A023VSF1

Ligands and binding sites

  • SO4 · Sulfate ion · ion · 5 copies · chains A
  • EDO · 1,2-ethanediol · additive · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
14830.780.8648SO4
21640.760.9324empty
32110.530.7728empty
4600.350.7817empty
5550.280.7418empty

Modifications

Observed in the structure: 6 modified (engineered).

Compared structures

  • 5BP8 · ent-Copalyl diphosphate synthase from Streptomyces platensis · the same entry in another collection · chain A against A, TM-score 1.00

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