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1C5M
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STRUCTURAL BASIS FOR SELECTIVITY OF A SMALL MOLECULE, S1-BINDING, SUB-MICROMOLAR INHIBITOR OF UROKINASE TYPE PLASMINOGEN ACTIVATOR
Descriptor:PROTEIN (COAGULATION FACTOR X)
Authors:Katz, B.A., Mackman, R., Luong, C., Radika, K., Martelli, A., Sprengeler, P.A., Wang, J., Chan, H., Wong, L.
Deposit date:1999-12-22
Release date:2000-12-22
Last modified:2017-10-04
Method:X-RAY DIFFRACTION (1.95 Å)
Cite:Structural basis for selectivity of a small molecule, S1-binding, submicromolar inhibitor of urokinase-type plasminogen activator.
Chem.Biol., 7, 2000
1EZQ
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CRYSTAL STRUCTURE OF HUMAN COAGULATION FACTOR XA COMPLEXED WITH RPR128515
Descriptor:COAGULATION FACTOR XA, CALCIUM ION, 3-[(3'-AMINOMETHYL-BIPHENYL-4-CARBONYL)-AMINO]-2-(3-CARBAMIMIDOYL-BENZYL)-BUTYRIC ACID METHYL ESTER
Authors:Maignan, S., Guilloteau, J.P., Pouzieux, S., Choi-Sledeski, Y.M., Becker, M.R., Klein, S.I., Ewing, W.R., Pauls, H.W., Spada, A.P., Mikol, V.
Deposit date:2000-05-11
Release date:2000-09-20
Last modified:2017-10-04
Method:X-RAY DIFFRACTION (2.2 Å)
Cite:Crystal structures of human factor Xa complexed with potent inhibitors.
J.Med.Chem., 43, 2000
1F0R
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CRYSTAL STRUCTURE OF HUMAN COAGULATION FACTOR XA COMPLEXED WITH RPR208815
Descriptor:COAGULATION FACTOR XA, CALCIUM ION, THIENO[3,2-B]PYRIDINE-2-SULFONIC ACID [1-(1-AMINO-ISOQUINOLIN-7-YLMETHYL)-2-OXO-PYRROLDIN-3-YL]-AMIDE
Authors:Maignan, S., Guilloteau, J.P., Pouzieux, S., Choi-Sledeski, Y.M., Becker, M.R., Klein, S.I., Ewing, W.R., Pauls, H.W., Spada, A.P., Mikol, V.
Deposit date:2000-05-17
Release date:2000-09-20
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:Crystal structures of human factor Xa complexed with potent inhibitors.
J.Med.Chem., 43, 2000
1F0S
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CRYSTAL STRUCTURE OF HUMAN COAGULATION FACTOR XA COMPLEXED WITH RPR208707
Descriptor:COAGULATION FACTOR XA, CALCIUM ION, THIENO[3,2-B]PYRIDINE-2-SULFONIC ACID [2-OXO-1-(1H-PYRROLO[2,3-C]PYRIDIN-2-YLMETHYL)-PYRROLIDIN-3-YL]-AMIDE
Authors:Maignan, S., Guilloteau, J.P., Pouzieux, S., Choi-Sledeski, Y.M., Becker, M.R., Klein, S.I., Ewing, W.R., Pauls, H.W., Spada, A.P., Mikol, V.
Deposit date:2000-05-17
Release date:2000-09-20
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:Crystal structures of human factor Xa complexed with potent inhibitors.
J.Med.Chem., 43, 2000
1FAX
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COAGULATION FACTOR XA INHIBITOR COMPLEX
Descriptor:FACTOR XA, CALCIUM ION, (2S)-3-(7-carbamimidoylnaphthalen-2-yl)-2-[4-({(3R)-1-[(1Z)-ethanimidoyl]pyrrolidin-3-yl}oxy)phenyl]propanoic acid
Authors:Brandstetter, H., Engh, R.A.
Deposit date:1996-08-23
Release date:1997-10-29
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (3 Å)
Cite:X-ray structure of active site-inhibited clotting factor Xa. Implications for drug design and substrate recognition.
J.Biol.Chem., 271, 1996
1FJS
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CRYSTAL STRUCTURE OF THE INHIBITOR ZK-807834 (CI-1031) COMPLEXED WITH FACTOR XA
Descriptor:COAGULATION FACTOR XA, CALCIUM ION, CHLORIDE ION, ...
Authors:Adler, M., Whitlow, M.
Deposit date:2000-08-08
Release date:2000-10-04
Last modified:2017-10-04
Method:X-RAY DIFFRACTION (1.92 Å)
Cite:Preparation, characterization, and the crystal structure of the inhibitor ZK-807834 (CI-1031) complexed with factor Xa.
Biochemistry, 39, 2000
1G2L
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FACTOR XA INHIBITOR COMPLEX
Descriptor:COAGULATION FACTOR X, CALCIUM ION, [(1-{2[(4-CARBAMIMIDOYL-PHENYLAMINO)-METHYL]-1-METHYL-1H-BENZOIMIDAZOL-5-YL}-CYCLOPROPYL)-PYRIDIN-2-YL-METHYLENEAMINOOXY]-ACETIC ACID ETHYL ESTER
Authors:Nar, H.
Deposit date:2000-10-20
Release date:2001-10-20
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:Structural basis for inhibition promiscuity of dual specific thrombin and factor Xa blood coagulation inhibitors.
Structure, 9, 2001
1G2M
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FACTOR XA INHIBITOR COMPLEX
Descriptor:COAGULATION FACTOR X, CALCIUM ION, 4-{[1-METHYL-5-(2-METHYL-BENZOIMIDAZOL-1-YLMETHYL)-1H-BENZOIMIDAZOL-2-YLMETHYL]-AMINO}-BENZAMIDINE
Authors:Nar, H.
Deposit date:2000-10-20
Release date:2001-10-20
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (3.02 Å)
Cite:Structural basis for inhibition promiscuity of dual specific thrombin and factor Xa blood coagulation inhibitors.
Structure, 9, 2001
1HCG
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STRUCTURE OF HUMAN DES(1-45) FACTOR XA AT 2.2 ANGSTROMS RESOLUTION
Descriptor:BLOOD COAGULATION FACTOR XA
Authors:Tulinsky, A., Padmanabhan, K.
Deposit date:1993-05-05
Release date:1995-05-08
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (2.2 Å)
Cite:Structure of human des(1-45) factor Xa at 2.2 A resolution.
J.Mol.Biol., 232, 1993
1IOE
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HUMAN COAGULATION FACTOR XA IN COMPLEX WITH M55532
Descriptor:COAGULATION FACTOR XA, CALCIUM ION, (-)-7-[(6-CHLORO-2-NAPHTHALENYL)SULFONYL]TETRAHYDRO-8A-(METHOXYMETHYL)-1'-(4-PYRIDINYL)-SPIRO[5H-OXAZOLO[3,2-A]PYRAZINE-2(3H),4'-PIPERIDIN]-5-ONE
Authors:Shiromizu, I., Matsusue, T.
Deposit date:2001-03-08
Release date:2003-09-23
Last modified:2017-10-04
Method:X-RAY DIFFRACTION (2.9 Å)
Cite:Factor Xa Specific Inhibitor That Induces the Novel Binding Model In Complex With Human FXa
To be Published
1IQE
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HUMAN COAGULATION FACTOR XA IN COMPLEX WITH M55590
Descriptor:coagulation Factor Xa, CALCIUM ION, 4-[(2R)-3-[[(6-CHLORO-2-NAPHTHALENYL)SULFONYL]AMINO]-1-OXO-2-[[[1-(4-PYRIDINYL)-4-PIPERIDINYL]METHYL]AMINO]PROPYL]-THIOMORPHOLINE-1,1-DIOXIDE
Authors:Shiromizu, I., Matsusue, T.
Deposit date:2001-07-23
Release date:2003-09-23
Last modified:2017-10-04
Method:X-RAY DIFFRACTION (2.9 Å)
Cite:Factor Xa Specific Inhibitor that Induces the Novel Binding Model in Complex with Human Fxa
To be Published
1IQF
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HUMAN COAGULATION FACTOR XA IN COMPLEX WITH M55165
Descriptor:coagulation Factor Xa, CALCIUM ION, (2R)-4-[(6-CHLORO-2-NAPHTHALENYL)SULFONYL]-6-OXO-1-[[1-(4-PYRIDINYL)-4-PIPERIDINYL]METHYL]-2-PIPERAZINECARBOXYLIC ACID ETHYL ESTER
Authors:Shiromizu, I., Matsusue, T.
Deposit date:2001-07-23
Release date:2003-09-23
Last modified:2017-10-04
Method:X-RAY DIFFRACTION (3.2 Å)
Cite:Factor Xa Specific Inhibitor that Induces the Novel Binding Model in Complex with Human Fxa
To be Published
1IQG
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HUMAN COAGULATION FACTOR XA IN COMPLEX WITH M55159
Descriptor:coagulation Factor Xa, CALCIUM ION, 4-[(6-CHLORO-2-NAPHTHALENYL)SULFONYL]-1-[[4-HYDROXYIMINOMETHYL-1-(4-PYRIDINYL)-4-PIPERIDINYL]METHYL]PIPERAZINONE
Authors:Shiromizu, I., Matsusue, T.
Deposit date:2001-07-23
Release date:2003-09-23
Last modified:2017-10-04
Method:X-RAY DIFFRACTION (2.6 Å)
Cite:Factor Xa Specific Inhibitor that Induces the Novel Binding Model in Complex with Human Fxa
To be Published
1IQH
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HUMAN COAGULATION FACTOR XA IN COMPLEX WITH M55143
Descriptor:coagulation Factor Xa, CALCIUM ION, 4-[(6-CHLORO-2-NAPHTHALENYL)SULFONYL]-1-[[4-HYDROXYMETHYL-1-(4-PYRIDINYL)-4-PIPERIDINYL]METHYL]PIPERAZINONE
Authors:Shiromizu, I., Matsusue, T.
Deposit date:2001-07-23
Release date:2003-09-23
Last modified:2017-10-04
Method:X-RAY DIFFRACTION (3 Å)
Cite:Factor Xa Specific Inhibitor that Induces the Novel Binding Model in Complex with Human Fxa
To be Published
1IQI
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HUMAN COAGULATION FACTOR XA IN COMPLEX WITH M55125
Descriptor:coagulation Factor Xa, CALCIUM ION, 4-[(6-CHLORO-2-NAPHTHALENYL)SULFONYL]-1-[[1-(4-PYRIDINYL)-4-PIPERIDINYL] METHYL]-2-PIPERAZINECARBOXYLIC ACID
Authors:Shiromizu, I., Matsusue, T.
Deposit date:2001-07-23
Release date:2003-09-23
Last modified:2017-10-04
Method:X-RAY DIFFRACTION (2.9 Å)
Cite:Factor Xa Specific Inhibitor that Induces the Novel Binding Model in Complex with Human Fxa
To be Published
1IQJ
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HUMAN COAGULATION FACTOR XA IN COMPLEX WITH M55124
Descriptor:coagulation Factor Xa, CALCIUM ION, 4-[(6-CHLORO-2-NAPHTHALENYL)SULFONYL]-1-[[1-(4-PYRIDINYL)-4-PIPERIDINYL]METHYL]-2-PIPERAZINECARBOXYLIC ACID ETHYL ESTER
Authors:Shiromizu, I., Matsusue, T.
Deposit date:2001-07-23
Release date:2003-09-23
Last modified:2017-10-04
Method:X-RAY DIFFRACTION (3 Å)
Cite:Factor Xa Specific Inhibitor that Induces the Novel Binding Model in Complex with Human Fxa
To be Published
1IQK
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HUMAN COAGULATION FACTOR XA IN COMPLEX WITH M55113
Descriptor:coagulation Factor Xa, CALCIUM ION, 4-[(6-CHLORO-2-NAPHTHALENYL)SULFONYL]-1-[[1-(4-PYRIDINYL)-4-PIPERIDINYL]METHYL]PIPERAZINONE
Authors:Shiromizu, I., Matsusue, T.
Deposit date:2001-07-23
Release date:2003-09-23
Last modified:2017-10-04
Method:X-RAY DIFFRACTION (3.2 Å)
Cite:Factor Xa Specific Inhibitor that Induces the Novel Binding Model in Complex with Human Fxa
To be Published
1IQL
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HUMAN COAGULATION FACTOR XA IN COMPLEX WITH M54476
Descriptor:coagulation Factor Xa, CALCIUM ION, 4-[[(1E)-2-(4-CHLOROPHENYL)ETHENYL]SULFONYL]-1-[[1-(4-PYRIDINYL)-4-PIPERIDINYL]METHYL]PIPERAZINONE
Authors:Shiromizu, I., Matsusue, T.
Deposit date:2001-07-23
Release date:2003-09-23
Last modified:2017-10-04
Method:X-RAY DIFFRACTION (2.7 Å)
Cite:Factor Xa Specific Inhibitor that Induces the Novel Binding Model in Complex with Human Fxa
To be Published
1IQM
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HUMAN COAGULATION FACTOR XA IN COMPLEX WITH M54471
Descriptor:coagulation Factor Xa, CALCIUM ION, 1-[[(1E)-2-(4-CHLOROPHENYL)ETHENYL]SULFONYL]-4-[[1-(4-PYRIDINYL)-4-PIPERIDINYL]METHYL]PIPERAZINE
Authors:Shiromizu, I., Matsusue, T.
Deposit date:2001-07-23
Release date:2003-09-23
Last modified:2017-10-04
Method:X-RAY DIFFRACTION (2.6 Å)
Cite:Factor Xa Specific Inhibitor that Induces the Novel Binding Model in Complex with Human Fxa
To be Published
1IQN
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HUMAN COAGULATION FACTOR XA IN COMPLEX WITH M55192
Descriptor:coagulation Factor Xa, CALCIUM ION, 4-[[4-[(6-CHLORO-2-NAPHTHALENYL)SULFONYL]-6-OXO-1-[[1-(4-PYRIDINYL)-4-PIPERIDINYL]METHYL]-2-PIPERAZINYL]CARBONYL]MORPHOLINE
Authors:Shiromizu, I., Matsusue, T.
Deposit date:2001-07-23
Release date:2003-09-23
Last modified:2017-10-04
Method:X-RAY DIFFRACTION (2.6 Å)
Cite:Factor Xa Specific Inhibitor that Induces the Novel Binding Model in Complex with Human Fxa
To be Published
1KSN
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CRYSTAL STRUCTURE OF HUMAN COAGULATION FACTOR XA COMPLEXED WITH FXV673
Descriptor:COAGULATION FACTOR XA, CALCIUM ION, METHYL-3-(4'-N-OXOPYRIDYLPHENOYL)-3-METHYL-2-(M-AMIDINOBENZYL)-PROPIONATE
Authors:Maignan, S., Guilloteau, J.P.
Deposit date:2002-01-14
Release date:2002-06-19
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:Optimization of the beta-aminoester class of factor Xa inhibitors. Part 2: Identification of FXV673 as a potent and selective inhibitor with excellent In vivo anticoagulant activity.
Bioorg.Med.Chem.Lett., 12, 2002
1LPG
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CRYSTAL STRUCTURE OF FXA IN COMPLEX WITH 79.
Descriptor:Blood coagulation factor Xa, CALCIUM ION, [4-({[5-BENZYLOXY-1-(3-CARBAMIMIDOYL-BENZYL)-1H-INDOLE-2-CARBONYL]-AMINO}-METHYL)-PHENYL]-TRIMETHYL-AMMONIUM
Authors:Schreuder, H.A., Brachvogel, V., Liesum, A.
Deposit date:2002-05-08
Release date:2003-05-08
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (2 Å)
Cite:Design and Quantitative Structure-Activity relationship of 3-amidinobenzyl-1H-indole-2-carboxamides as potent, nonchiral, and selective inhibitors of blood coagulation factor Xa.
J.Med.Chem., 45, 2002
1LPK
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CRYSTAL STRUCTURE OF FXA IN COMPLEX WITH 125.
Descriptor:Blood coagulation factor Xa, CALCIUM ION, 1-(3-CARBAMIMIDOYL-BENZYL)-1H-INDOLE-2-CARBOXYLIC ACID 3-CARBAMIMIDOYL-BENZYLESTER
Authors:Schreuder, H.A., Loenze, P., Brachvogel, V., Liesum, A.
Deposit date:2002-05-08
Release date:2003-05-08
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (2.2 Å)
Cite:Design and Quantitative Structure-Activity relationship of 3-amidinobenzyl-1H-indole-2-carboxamides as potent, nonchiral, and selective inhibitors of blood coagulation factor Xa
J.Med.Chem., 45, 2002
1LPZ
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CRYSTAL STRUCTURE OF FXA IN COMPLEX WITH 41.
Descriptor:Blood coagulation factor Xa, CALCIUM ION, 1-(3-carbamimidoylbenzyl)-N-(3,5-dichlorobenzyl)-4-methyl-1H-indole-2-carboxamide
Authors:Schreuder, H.A., Brachvogel, V., Liesum, A.
Deposit date:2002-05-08
Release date:2003-05-08
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (2.4 Å)
Cite:Design and Quantitative Structure-Activity relationship of 3-amidinobenzyl-1H-indole-2-carboxamides as potent, nonchiral, and selective inhibitors of blood coagulation factor Xa
J.Biol.Chem., 45, 2002
1LQD
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CRYSTAL STRUCTURE OF FXA IN COMPLEX WITH 45.
Descriptor:Blood coagulation factor Xa, CALCIUM ION, 1-(3-CARBAMIMIDOYL-BENZYL)-4-METHYL-1H-INDOLE-2-CARBOXYLIC ACID 3,5-DIMETHYL-BENZYLAMIDE
Authors:Schreuder, H.A., Loenze, P., Brachvogel, V., Liesum, A.
Deposit date:2002-05-10
Release date:2003-05-10
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (2.7 Å)
Cite:Design and Quantitative Structure-Activity relationship of 3-amidinobenzyl-1H-indole-2-carboxamides as potent, nonchiral, and selective inhibitors of blood coagulation factor Xa
J.Med.Chem., 45, 2002
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