9INR
Crystal structure of PIN1 in complex with inhibitor C3
This is a non-PDB format compatible entry.
Summary for 9INR
Entry DOI | 10.2210/pdb9inr/pdb |
Descriptor | Peptidyl-prolyl cis-trans isomerase NIMA-interacting 1, ~{N}-[(2~{S})-3-[1-[4-(4-cyanophenyl)phenyl]-1,2,3-triazol-4-yl]-1-[(3-oxidanylcyclobutyl)amino]-1-oxidanylidene-propan-2-yl]-1-phenyl-cyclopropane-1-carboxamide, SULFATE ION, ... (5 entities in total) |
Functional Keywords | inhibitor, complex, isomerase |
Biological source | Homo sapiens (human) |
Total number of polymer chains | 2 |
Total formula weight | 38386.56 |
Authors | |
Primary citation | Liu, C.,Chen, Z.,Chen, T.,Song, H.,Shen, J.,Yuan, X.,Xia, S.,Liu, Q.,Chen, Q.,Tian, Q.,Meng, X.,Han, Z.,Dong, X.,Yang, Y.,Cai, L.,Cheng, X.,Jia, Y.,Liu, G.,Li, J.,Ge, J.,Dou, D. Re-Evaluating PIN1 as a Therapeutic Target in Oncology Using Neutral Inhibitors and PROTACs. J.Med.Chem., 67:15780-15795, 2024 Cited by PubMed: 39229909DOI: 10.1021/acs.jmedchem.4c01412 PDB entries with the same primary citation |
Experimental method | X-RAY DIFFRACTION (1.93 Å) |
Structure validation
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