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Structure of the substrate-free form of the rebeccamycin biosynthetic enzyme rebc

Analyse Structure of the substrate-free form of the rebeccamycin biosynthetic enzyme… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
2R0C
Type
protein
Length
509 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Rebc
UniProt
Q8KI25
Ligands
FAD, CL
Pockets
3 · best druggability 0.83

Structure

x-ray diffraction · 1 distinct chain · 32% helix, 26% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ARebcprotein50932% helix, 26% strandQ8KI25

Ligands and binding sites

  • FAD · Flavin-adenine dinucleotide · ligand · chains A
  • CL · Chloride ion · ion · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
110530.830.84125FAD
21000.410.7717empty
3980.400.7722empty

Compared structures

  • 2R0C · Structure of the substrate-free form of the rebeccamycin biosynthetic enzyme REBC · the same entry in another collection · chain A against A, TM-score 1.00

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