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Structure of gtpebb-dihydrobiliverdin complex

Analyse Structure of gtpebb-dihydrobiliverdin complex in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6QX6
Type
protein
Length
526 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Ferredoxin bilin reductase plastid
UniProt
L1IWQ9
Ligands
DBV, SO4
Pockets
5 · best druggability 0.72

Structure

x-ray diffraction · 2 distinct chains · 44% helix, 21% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AFerredoxin bilin reductase plastidprotein26444% helix, 20% strandL1IWQ9
BFerredoxin bilin reductase plastidprotein26245% helix, 22% strandL1IWQ9

Ligands and binding sites

  • DBV · 15,16-dihydrobiliverdin · ligand · 2 copies · chains A, B
  • SO4 · Sulfate ion · ion · 5 copies · chains A, B
  • 1PE · Pentaethylene glycol · additive · chains A, B

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
12780.720.8536DBV
22560.710.8537DBV
31210.500.8022empty
41590.470.76281PE
51150.400.7527empty

Interfaces

1 interface between chains.

  • A–B · 275 Ų buried · 2 hydrogen bonds · protein-protein

Compared structures

  • 6QX6 · Structure of gtPebB-dihydrobiliverdin complex · the same entry in another collection · chain A against A, TM-score 1.00

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