8Q3U

Crystal structure of a fentanyl derivative in complex with human CA VII

Summary for 8Q3U

Entry DOI	10.2210/pdb8q3u/pdb
Descriptor	Carbonic anhydrase 7, ZINC ION, ~{N}-phenyl-~{N}-[1-[2-(4-sulfamoylphenyl)ethyl]piperidin-4-yl]propanamide, ... (5 entities in total)
Functional Keywords	carbonic anhydrase, fentanyl derivative, metalloenzyme, complex, lyase
Biological source	Homo sapiens (human)
Total number of polymer chains	1
Total formula weight	31590.84
Authors	Alterio, V.,Di Fiore, A.,De Simone, G. (deposition date: 2023-08-04, release date: 2023-09-20)
Primary citation	Angeli, A.,Micheli, L.,Turnaturi, R.,Pasquinucci, L.,Parenti, C.,Alterio, V.,Di Fiore, A.,De Simone, G.,Monti, S.M.,Carta, F.,Di Cesare Mannelli, L.,Ghelardini, C.,Supuran, C.T. Discovery of a novel series of potent carbonic anhydrase inhibitors with selective affinity for mu Opioid receptor for Safer and long-lasting analgesia. Eur.J.Med.Chem., 260:115783-115783, 2023 Cited by PubMed: 37678143 DOI: 10.1016/j.ejmech.2023.115783 PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (1.1 Å)

Structure validation