EMDB/PDB/SASBDBから引用されている文献のデータベース

キーワード
構造解析手法	All X線回折 NMR 電子顕微鏡小角散乱中性子線回折線維回折粉末回折赤外分光 EPR FRET 理論モデルハイブリッド
著者・登録者
ジャーナル
IF	>30 >20 >10 >5 all

タイトル	Ligand binding stepwise disrupts water network in thrombin: enthalpic and entropic changes reveal classical hydrophobic effect
ジャーナル・号・ページ	J. Med. Chem., Vol. 55, Page 6094-6110, Year 2012
掲載日	2011年4月20日 (構造データの登録日)
著者	Biela, A. / Sielaff, F. / Terwesten, F. / Heine, A. / Steinmetzer, T. / Klebe, G.
リンク	J. Med. Chem. / PubMed:22612268
手法	X線回折
解像度	1.23 - 1.78 Å
構造データ	PDB-3rlw: Human Thrombin in complex with MI328 手法: X-RAY DIFFRACTION / 解像度: 1.69 Å PDB-3rly: Human Thrombin in complex with MI329 手法: X-RAY DIFFRACTION / 解像度: 1.51 Å PDB-3rm0: Human Thrombin in complex with MI354 手法: X-RAY DIFFRACTION / 解像度: 1.34 Å PDB-3rm2: Human Thrombin in complex with MI003 手法: X-RAY DIFFRACTION / 解像度: 1.23 Å PDB-3rml: Human Thrombin in complex with MI331 手法: X-RAY DIFFRACTION / 解像度: 1.53 Å PDB-3rmm: Human Thrombin in complex with MI332 手法: X-RAY DIFFRACTION / 解像度: 1.58 Å PDB-3rmn: Human Thrombin in complex with MI341 手法: X-RAY DIFFRACTION / 解像度: 1.78 Å PDB-3rmo: Human Thrombin in complex with MI004 手法: X-RAY DIFFRACTION / 解像度: 1.4 Å PDB-3t5f: Human Thrombin In Complex With MI340 手法: X-RAY DIFFRACTION / 解像度: 1.45 Å PDB-3uwj: Human Thrombin In Complex With MI353 手法: X-RAY DIFFRACTION / 解像度: 1.5 Å
化合物	ChemComp-NAG: 2-acetamido-2-deoxy-beta-D-glucopyranose / N-アセチル-β-D-グルコサミン ChemComp-S28: N-(benzylsulfonyl)glycyl-N-(4-carbamimidoylbenzyl)-L-prolinamide ChemComp-PO4: PHOSPHATE ION / ホスファ-ト ChemComp-GOL: GLYCEROL / グリセロ-ル ChemComp-NA: Unknown entry / ナトリウムカチオン ChemComp-HOH: WATER ChemComp-S29: N-(benzylsulfonyl)-D-alanyl-N-(4-carbamimidoylbenzyl)-L-prolinamide ChemComp-S54: N-(benzylsulfonyl)-D-valyl-N-(4-carbamimidoylbenzyl)-L-prolinamide ChemComp-S00: N-(benzylsulfonyl)-3-cyclohexyl-D-alanyl-N-(4-carbamimidoylbenzyl)-L-prolinamide ChemComp-M31: N-(benzylsulfonyl)glycyl-N-[2-(aminomethyl)-5-chlorobenzyl]-L-prolinamide ChemComp-M32: N-(benzylsulfonyl)-D-alanyl-N-[2-(aminomethyl)-5-chlorobenzyl]-L-prolinamide ChemComp-M41: N-(benzylsulfonyl)-D-valyl-N-[2-(aminomethyl)-5-chlorobenzyl]-L-prolinamide ChemComp-S04: N-(benzylsulfonyl)-3-cyclohexyl-D-alanyl-N-[2-(aminomethyl)-5-chlorobenzyl]-L-prolinamide ChemComp-M34: N-(benzylsulfonyl)-D-leucyl-N-[2-(aminomethyl)-5-chlorobenzyl]-L-prolinamide ChemComp-TIF: N-(benzylsulfonyl)-D-leucyl-N-(4-carbamimidoylbenzyl)-L-prolinamide
由来	homo sapiens (ヒト) hirudo medicinalis (医用ビル)
キーワード	HYDROLASE/HYDROLASE INHIBITOR / Serine Protease / Kringle / Hydrolase / Blood Coagulation / Blood Clotting / Convertion of Fibrinogen to Fibrin / Cleavage on Pairs of Basic Residues / Hirudin / Glycosylation / Blood / HYDROLASE-HYDROLASE INHIBITOR complex / Convertion of Fibrinogen