2XCF

Crystal structure of HCV NS3 protease with a boronate inhibitor

2XCF の概要

分子名称NS3 PROTEASE, NS4A, ZINC ION, ... (6 entities in total)
機能のキーワードprotease, boronate inhibitor, viral reproduction, hydrolase
由来する生物種HEPATITIS C VIRUS
ポリマー鎖数4
分子量合計47604.93
構造登録者
主引用文献
Li, X.,Zhang, Y.-K.,Liu, Y.,Ding, C.Z.,Li, Q.,Zhou, Y.,Plattner, J.J.,Baker, S.J.,Qian, X.,Fan, D.,Liao, L.,Ni, Z.-J.,White, G.V.,Mordaunt, J.E.,Lazarides, L.X.,Slater, M.J.,Jarvest, R.L.,Edge, C.M.,Hubbard, J.A.,Nassau, P.,Mcdowell, B.,Skarzynski, T.J.,Thommes, P.,Ellis, M.,Rowland, P.,Somers, D.O.,Kazmierski, W.M.,Grimes, R.M.,Wright, L.L.,Smith, G.K.,Zou, W.,Wright, J.,Pennicott, L.E.
Synthesis and Evaluation of Novel Alpha-Amino Cyclic Boronates as Inhibitors of Hcv Ns3 Protease.
Bioorg.Med.Chem.Lett., 20:3550-, 2010
PubMed: 20493689 (主引用文献が同じPDBエントリー)
DOI: 10.1016/J.BMCL.2010.04.129
MImport into Mendeley
実験手法
X-RAY DIFFRACTION (2.48 Å)
NMR情報
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構造検証レポート

RfreeClashscoreRamachandran outliersSidechain outliersRSRZ outliers 0.22030 4.4% 0.5%MetricValuePercentile RanksWorseBetterPercentile relative to all X-ray structuresPercentile relative to X-ray structures of similar resolution
検証レポート(詳細版)をダウンロード

他の静止画像(非対称単位)

Molmil generated image of 2xcf
回転なし
Molmil generated image of 2xcf
x軸(左右方向)周りに90°回転
Molmil generated image of 2xcf
y軸(上下方向)周りに90°回転