2XK1

Crystal structure of a complex between Actinomadura R39 DD-peptidase and a boronate inhibitor

Summary for 2XK1

Entry DOI	10.2210/pdb2xk1/pdb
Related	1W79 1W8Q 1W8Y 2VGJ 2VGK 2WKE 2XDM
Descriptor	D-ALANYL-D-ALANINE CARBOXYPEPTIDASE, [(1S)-1-{[(2-benzylphenyl)carbonyl]amino}ethyl](trihydroxy)borate(1-), SULFATE ION, ... (5 entities in total)
Functional Keywords	hydrolase, peptidoglycan
Biological source	ACTINOMADURA SP
Cellular location	Secreted: P39045
Total number of polymer chains	4
Total formula weight	193561.30
Authors	Sauvage, E.,Herman, R.,Kerff, F.,Rocaboy, M.,Charlier, P. (deposition date: 2010-07-07, release date: 2011-01-26, Last modification date: 2023-12-20)
Primary citation	Woon, E.C.Y.,Zervosen, A.,Sauvage, E.,Simmons, K.J.,Ivec, M.,Inglis, S.R.,Fishwick, C.W.G.,Gobec, S.,Charlier, P.,Luxen, A.,Schofield, C.J. Structure Guided Development of Potent Reversibly Binding Penicillin Binding Protein Inhibitors Acs Med.Chem.Lett., 2:219-, 2011 Cited by PubMed: 24900305 DOI: 10.1021/ML100260X PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (2.8 Å)

Structure validation