4MS0
Crystal structure of PDE10A2 with fragment ZT0443 (6-chloropyrimidine-2,4-diamine)
Summary for 4MS0
Entry DOI | 10.2210/pdb4ms0/pdb |
Related | 4MRW 4MRZ 4MSA 4MSC 4MSE 4MSH 4MSN |
Descriptor | cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A, 6-chloropyrimidine-2,4-diamine, NICKEL (II) ION, ... (4 entities in total) |
Functional Keywords | fragment screening, hydrolase, hydrolase-hydrolase inhibitor complex, hydrolase/hydrolase inhibitor |
Biological source | Homo sapiens (human) |
Cellular location | Cytoplasm: Q9Y233 |
Total number of polymer chains | 2 |
Total formula weight | 79337.82 |
Authors | Sridhar, V.,Badger, J.,Logan, C.,Chie-Leon, B.,Nienaber, V. (deposition date: 2013-09-18, release date: 2014-05-14, Last modification date: 2023-09-20) |
Primary citation | Recht, M.I.,Sridhar, V.,Badger, J.,Bounaud, P.Y.,Logan, C.,Chie-Leon, B.,Nienaber, V.,Torres, F.E. Identification and optimization of PDE10A inhibitors using fragment-based screening by nanocalorimetry and X-ray crystallography. J Biomol Screen, 19:497-507, 2014 Cited by PubMed: 24375910DOI: 10.1177/1087057113516493 PDB entries with the same primary citation |
Experimental method | X-RAY DIFFRACTION (1.79 Å) |
Structure validation
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