4DKT

Crystal structure of human peptidylarginine deiminase 4 in complex with N-acetyl-L-threonyl-L-alpha-aspartyl-N5-[(1E)-2-fluoroethanimidoyl]-L-ornithinamide

Summary for 4DKT

Entry DOI	10.2210/pdb4dkt/pdb
Related PRD ID	PRD_000781
Descriptor	Protein-arginine deiminase type-4, Thr-Asp-F-amidine, CALCIUM ION, ... (6 entities in total)
Functional Keywords	alpha/beta-propeller, immunoglobulin-like, arginine citrullination, post-translational, hydrolase-hydrolase inhibitor complex, hydrolase/hydrolase inhibitor
Biological source	Homo sapiens (human)
Cellular location	Cytoplasm: Q9UM07
Total number of polymer chains	2
Total formula weight	75540.59
Authors	Jones, J.E.,Slack, J.L.,Fang, P.,Zhang, X.,Subramanian, V.,Causey, C.P.,Coonrod, S.A.,Guo, M.,Thompson, P.R. (deposition date: 2012-02-04, release date: 2012-02-29, Last modification date: 2023-11-15)
Primary citation	Jones, J.E.,Slack, J.L.,Fang, P.,Zhang, X.,Subramanian, V.,Causey, C.P.,Coonrod, S.A.,Guo, M.,Thompson, P.R. Synthesis and Screening of a Haloacetamidine Containing Library To Identify PAD4 Selective Inhibitors. Acs Chem.Biol., 7:160-165, 2012 Cited by PubMed: 22004374 DOI: 10.1021/cb200258q PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (2.98 Å)

Structure validation