6X0T

Structure of human plasma factor XIIa in complex with (2S)-1-(N,3-dicyclohexyl-D-alanyl)-4-[(4R,5S)-4-methyl-5-phenyl-4,5-dihydro-1,3-oxazol-2-yl]-N-[(thiophen-2-yl)methyl]piperazine-2-carboxamide (compound 8h)

Summary for 6X0T

Entry DOI	10.2210/pdb6x0t/pdb
Descriptor	Coagulation factor XII, (2S)-1-(N,3-dicyclohexyl-D-alanyl)-4-[(4R,5S)-4-methyl-5-phenyl-4,5-dihydro-1,3-oxazol-2-yl]-N-[(thiophen-2-yl)methyl]piperazine-2-carboxamide, SULFATE ION, ... (4 entities in total)
Functional Keywords	protease, blood clotting, inhibitor
Biological source	Homo sapiens (Human)
Total number of polymer chains	3
Total formula weight	85765.35
Authors	Orth, P. (deposition date: 2020-05-17, release date: 2021-05-19, Last modification date: 2023-10-18)
Primary citation	Rao, A.U.,Chu, H.D. Structure of human plasma factor XIIa in complex with (2S)-1-(N,3-dicyclohexyl-D-alanyl)-4-[(4R,5S)-4-methyl-5-phenyl-4,5-dihydro-1,3-oxazol-2-yl]-N-[(thiophen-2-yl)methyl]piperazine-2-carboxamide (compound 8h) To Be Published,
Experimental method	X-RAY DIFFRACTION (1.388 Å)

Structure validation