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6E8X

CA IX mimic Complexed with Steroidal Sulfamate Compound STX 140

Summary for 6E8X
Entry DOI10.2210/pdb6e8x/pdb
DescriptorCarbonic anhydrase 2, ZINC ION, (13alpha,17alpha)-2-methoxyestra-1,3,5,7,9,11-hexaene-3,17-diyl disulfamate, ... (4 entities in total)
Functional Keywordscarbonic anhydrase steroid sulfamate cancer, lyase
Biological sourceHomo sapiens (Human)
Total number of polymer chains1
Total formula weight29364.39
Authors
Andring, J.T.,Mckenna, R. (deposition date: 2018-07-31, release date: 2019-03-27, Last modification date: 2023-10-11)
Primary citationAndring, J.T.,Dohle, W.,Tu, C.,Potter, B.V.L.,McKenna, R.
3,17 beta-Bis-sulfamoyloxy-2-methoxyestra-1,3,5(10)-triene and Nonsteroidal Sulfamate Derivatives Inhibit Carbonic Anhydrase IX: Structure-Activity Optimization for Isoform Selectivity.
J. Med. Chem., 62:2202-2212, 2019
Cited by
PubMed: 30721041
DOI: 10.1021/acs.jmedchem.8b01990
PDB entries with the same primary citation
Experimental method
X-RAY DIFFRACTION (1.6 Å)
Structure validation

219869

数据于2024-05-15公开中

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