4PIQ

Crystal structure of human adenovirus 8 protease with a nitrile inhibitor

Summary for 4PIQ

Entry DOI	10.2210/pdb4piq/pdb
Related	1NLN 4PIE 4PIS
Descriptor	Protease, PVI, N-[(3,5-dichlorophenyl)acetyl]-L-threonyl-N-[(2Z)-2-iminoethyl]glycinamide, ... (4 entities in total)
Functional Keywords	adenain, adenovirus, cysteine protease, pvic, cofactor, inhibitor, hydrolase-hydrolase inhibitor complex, hydrolase/hydrolase inhibitor
Biological source	Human adenovirus 8 (HAdV-8) More
Total number of polymer chains	2
Total formula weight	24767.26
Authors	Mac Sweeney, A.,Grosche, P.,Ellis, D.,Combrink, K.,Erbel, P.,Hughes, N.,Sirockin, F.,Melkko, S.,Bernardi, A.,Ramage, P.,Jarousse, N.,Altmann, E. (deposition date: 2014-05-09, release date: 2014-09-10, Last modification date: 2023-12-27)
Primary citation	Mac Sweeney, A.,Grosche, P.,Ellis, D.,Combrink, K.,Erbel, P.,Hughes, N.,Sirockin, F.,Melkko, S.,Bernardi, A.,Ramage, P.,Jarousse, N.,Altmann, E. Discovery and structure-based optimization of adenain inhibitors. Acs Med.Chem.Lett., 5:937-941, 2014 Cited by PubMed: 25147618 DOI: 10.1021/ml500224t PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (2.07 Å)

Structure validation