3TU7

Human alpha-thrombin complexed with N-(methylsulfonyl)-D-phenylalanyl-N-((1-carbamimidoyl-4-piperidinyl)methyl)-l-prolinamide (BMS-189664)

3TU7 の概要

• エントリーDOI: 10.2210/pdb3tu7/pdb
• 関連するBIRD辞書のPRD_ID: PRD_000811
• 分子名称: Prothrombin, Hirudin variant-2, N-(methylsulfonyl)-D-phenylalanyl-N-[(1-carbamimidoylpiperidin-4-yl)methyl]-L-prolinamide, ... (5 entities in total)
• 機能のキーワード: serine protease, hydrolase-hydrolase inhibitor complex, hydrolase/hydrolase inhibitor
• 由来する生物種: Homo sapiens (human); 詳細
• 細胞内の位置: Secreted, extracellular space: P00734 P00734; Secreted: P09945
• タンパク質・核酸の鎖数: 3
• 化学式量合計: 35903.86

構造登録者

Malley, M.,Sack, J.S. (登録日: 2011-09-16, 公開日: 2011-10-12, 最終更新日: 2012-12-12)

• 主引用文献: Das, J.,Kimball, S.D.,Hall, S.E.,Han, W.C.,Iwanowicz, E.,Lin, J.,Moquin, R.V.,Reid, J.A.,Sack, J.S.,Malley, M.F.,Chang, C.Y.,Chong, S.,Wang-Iverson, D.B.,Roberts, D.G.,Seiler, S.M.,Schumacher, W.A.,Ogletree, M.L.; Molecular design and structure-activity relationships leading to the potent, selective, and orally active thrombin active site inhibitor BMS-189664.; Bioorg.Med.Chem.Lett., 12:45-49, 2002; PubMed: 11738570

実験手法

X-RAY DIFFRACTION (2.49 Å)