6G9S

Structural basis for the inhibition of E. coli PBP2

6G9S の概要

関連するPDBエントリー6G9P 6G9F
分子名称Peptidoglycan D,D-transpeptidase MrdA, (3~{R},6~{S})-6-(aminomethyl)-4-(1,3-oxazol-5-yl)-3-(sulfooxyamino)-3,6-dihydro-2~{H}-pyridine-1-carboxylic acid (3 entities in total)
機能のキーワードpenicillin binding protein, hydrolase-antibiotic complex, hydrolase/antibiotic
由来する生物種Escherichia coli
ポリマー鎖数1
分子量合計65409.83
構造登録者
Ruff, M.,Levy, N. (登録日: 2018-04-11, 公開日: 2019-05-22)
主引用文献
Levy, N.,Bruneau, J.M.,Le Rouzic, E.,Bonnard, D.,Le Strat, F.,Caravano, A.,Chevreuil, F.,Barbion, J.,Chasset, S.,Ledoussal, B.,Moreau, F.,Ruff, M.
Structural Basis for E. coli Penicillin Binding Protein (PBP) 2 Inhibition, a Platform for Drug Design.
J.Med.Chem., 62:4742-4754, 2019
PubMed: 30995398 (主引用文献が同じPDBエントリー)
DOI: 10.1021/acs.jmedchem.9b00338
MImport into Mendeley
実験手法
X-RAY DIFFRACTION (2.001 Å)
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構造検証レポート

RfreeClashscoreRamachandran outliersSidechain outliersRSRZ outliers 0.2605 0.4% 1.6% 1.3%MetricValuePercentile RanksWorseBetterPercentile relative to all X-ray structuresPercentile relative to X-ray structures of similar resolution
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