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Crystal structure of human PDE10A in complex with inhibitor 16D

Analyse Crystal structure of human PDE10A in complex with inhibitor 16D in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
5UWF
Type
protein
Length
647 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
UniProt
Q9Y233
Ligands
8Q7, ZN, MG

Structure

x-ray diffraction · 2 distinct chains.

ChainMoleculeTypeResiduesSecondary structureUniProt
C—protein323—Q9Y233
D—protein324—Q9Y233

Ligands and binding sites

  • 8Q7 · 9-[(1S)-2,2-difluorocyclopropane-1-carbonyl]-6-[(4-methoxyphenyl)methyl]-8,9,10,11-tetrahydropyrido[4', 3':4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-5(6H)-one · ligand · 2 copies · chains C, D
  • ZN · Zinc ion · metal · 2 copies · chains C, D
  • MG · Magnesium ion · metal · 2 copies · chains C, D

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

Compared structures

  • 5UWF · Crystal structure of human PDE10A in complex with inhibitor 16d · the same entry in another collection · chain C against C, TM-score 1.00

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