4buz Summary details

pdbe.org/4buz/summary_details
spacer SIR2 COMPLEX STRUCTURE MIXTURE OF EX-527 INHIBITOR AND REACTION PRODUCTS OR OF REACTION SUBSTRATES P53 PEPTIDE AND NAD
Summary
Header HYDROLASEsearch
Method X-RAY DIFFRACTION
Experiment Resolution: 1.9 Å, R-factor: 16.104%, Free R-factor: 19.357%, Spacegroup: P 21 21 21
Released 17/07/2013, deposition: 24/06/2013, last revision: 07/08/2013
Authors Weyand, M.search; Lakshminarasimhan, M.search; Gertz, M.search; Steegborn, C.search
Primary citation Ex-527 Inhibits Sirtuins by Exploiting Their Unique Nad+-Dependent Deacetylation Mechanism
PROC.NATL.ACAD.SCI.USAsearch vol:110, pag:E2772 (2013) [PubMed 23840057 ]search
Keywords HYDROLASEsearch, NAD-DEPENDENT DEACETYLASEsearch, SIRTUINsearch, INHIBITOR COMPLEXsearch, EX-527search, RUNNING REACTIONsearch
EC 3.5.1.- ExPASy BRENDA search (A)
Organism Thermotoga maritima 2336search(A),Homo sapiens(human) 9606search(P)
UniProt Q9WYW0search (A)
P04637search (P)
Solvent A, P
Related entries 4bv2, 4bv3, 4bvb, 4bve, 4bvf, 4bvg, 4bvh
Polymers
Chain Id Name Type UniProt Residues in sample sequence % of sample sequence observed
A NAD-DEPENDENT PROTEIN DEACETYLASE Protein Q9WYW0 (NPD_THEMA)search
246 96%
P CELLULAR TUMOR ANTIGEN P53 Protein P04637 (P53_HUMAN)search
8 87%
Heterogens
Chain Id Name Ligands
A (1S)-6-CHLORO-2,3,4,9-TETRAHYDRO-1H-CARBAZOLE-1- CARBOXAMIDE OCZ search
A NICOTINAMIDE-ADENINE-DINUCLEOTIDE NAD search
A 2'-O-ACETYL ADENOSINE-5-DIPHOSPHORIBOSE OAD search
A ZINC ION ZN search
A 1,2-ETHANEDIOL EDO search
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