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Sy-crte ipp structure

Analyse Sy-crte ipp structure in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
7MY0
Type
protein
Length
574 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Geranylgeranyl pyrophosphate synthase
UniProt
P72683
Ligands
IPE, MG
Pockets
4 · best druggability 0.70

Structure

x-ray diffraction · 2 distinct chains · 77% helix, 1% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AGeranylgeranyl pyrophosphate synthaseprotein28677% helix, 1% strandP72683
BGeranylgeranyl pyrophosphate synthaseprotein28877% helix, 1% strandP72683

Ligands and binding sites

  • IPE · 3-methylbut-3-enyl trihydrogen diphosphate · ligand · 2 copies · chains A, B
  • MG · Magnesium ion · metal · 8 copies · chains A, B
  • GOL · Glycerol · additive · chains A

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

Pockets

4 pockets found on a 1 Å grid, 2 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
15970.700.7950IPE, MG
25770.700.7955IPE, MG
3540.430.8214empty
4630.390.7913empty

Interfaces

1 interface between chains.

  • A–B · 2018 Ų buried · 5 hydrogen bonds · protein-protein

Compared structures

  • 7MY0 · Sy-CrtE IPP structure · the same entry in another collection · chain A against A, TM-score 1.00

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