2EUN
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![BU of 2eun by Molmil](/molmil-images/mine/2eun) | Cytochrome c peroxidase (CCP) in complex with 2,4-diaminopyrimidine | 分子名称: | PROTOPORPHYRIN IX CONTAINING FE, PYRIMIDINE-2,4-DIAMINE, cytochrome c peroxidase | 著者 | Brenk, R, Vetter, S.W, Boyce, S.E, Goodin, D.B, Shoichet, B.K. | 登録日 | 2005-10-29 | 公開日 | 2006-04-11 | 最終更新日 | 2024-02-14 | 実験手法 | X-RAY DIFFRACTION (1.7 Å) | 主引用文献 | Probing molecular docking in a charged model binding site. J.Mol.Biol., 357, 2006
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2AQD
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![BU of 2aqd by Molmil](/molmil-images/mine/2aqd) | cytochrome c peroxidase (CCP) in complex with 2,5-diaminopyridine | 分子名称: | Cytochrome c peroxidase, mitochondrial, PROTOPORPHYRIN IX CONTAINING FE, ... | 著者 | Brenk, R, Vetter, S.W, Boyce, S.E, Goodin, D.B, Shoichet, B.K. | 登録日 | 2005-08-17 | 公開日 | 2006-04-11 | 最終更新日 | 2023-08-23 | 実験手法 | X-RAY DIFFRACTION (1.35 Å) | 主引用文献 | Probing molecular docking in a charged model binding site. J.Mol.Biol., 357, 2006
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2AS2
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![BU of 2as2 by Molmil](/molmil-images/mine/2as2) | cytochrome c peroxidase in complex with 2-iminopiperidine | 分子名称: | Cytochrome c peroxidase, mitochondrial, PIPERIDIN-2-IMINE, ... | 著者 | Brenk, R, Vetter, S.W, Boyce, S.E, Goodin, D.B, Shoichet, B.K. | 登録日 | 2005-08-22 | 公開日 | 2006-04-11 | 最終更新日 | 2023-08-23 | 実験手法 | X-RAY DIFFRACTION (1.45 Å) | 主引用文献 | Probing molecular docking in a charged model binding site. J.Mol.Biol., 357, 2006
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2EUT
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![BU of 2eut by Molmil](/molmil-images/mine/2eut) | Cytochrome c peroxidase (CCP) in complex with 2-amino-4-picoline | 分子名称: | 4-METHYLPYRIDIN-2-AMINE, PROTOPORPHYRIN IX CONTAINING FE, cytochrome c peroxidase | 著者 | Brenk, R, Vetter, S.W, Boyce, S.E, Goodin, D.B, Shoichet, B.K. | 登録日 | 2005-10-29 | 公開日 | 2006-04-11 | 最終更新日 | 2023-08-23 | 実験手法 | X-RAY DIFFRACTION (1.12 Å) | 主引用文献 | Probing molecular docking in a charged model binding site. J.Mol.Biol., 357, 2006
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2EUP
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![BU of 2eup by Molmil](/molmil-images/mine/2eup) | Cytochrome c peroxidase (CCP) in complex with 2-amino-5-picoline | 分子名称: | 5-METHYLPYRIDIN-2-AMINE, PROTOPORPHYRIN IX CONTAINING FE, cytochrome c peroxidase | 著者 | Brenk, R, Vetter, S.W, Boyce, S.E, Goodin, D.B, Shoichet, B.K. | 登録日 | 2005-10-29 | 公開日 | 2006-04-11 | 最終更新日 | 2023-08-23 | 実験手法 | X-RAY DIFFRACTION (1.4 Å) | 主引用文献 | Probing molecular docking in a charged model binding site. J.Mol.Biol., 357, 2006
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2EUU
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![BU of 2euu by Molmil](/molmil-images/mine/2euu) | Cytochrome c peroxidase (CCP) in complex with 1H-imidazol-2-ylmethanol | 分子名称: | 1H-IMIDAZOL-2-YLMETHANOL, PROTOPORPHYRIN IX CONTAINING FE, cytochrome c peroxidase | 著者 | Brenk, R, Vetter, S.W, Boyce, S.E, Goodin, D.B, Shoichet, B.K. | 登録日 | 2005-10-29 | 公開日 | 2006-04-11 | 最終更新日 | 2023-08-23 | 実験手法 | X-RAY DIFFRACTION (1.45 Å) | 主引用文献 | Probing molecular docking in a charged model binding site. J.Mol.Biol., 357, 2006
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2EUO
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![BU of 2euo by Molmil](/molmil-images/mine/2euo) | Cytochrome c peroxidase (CCP) in complex with 1-methyl-1-lambda-5-pyridin-3-yl-amine | 分子名称: | 1-METHYL-1,6-DIHYDROPYRIDIN-3-AMINE, PROTOPORPHYRIN IX CONTAINING FE, cytochrome c peroxidase | 著者 | Brenk, R, Vetter, S.W, Boyce, S.E, Goodin, D.B, Shoichet, B.K. | 登録日 | 2005-10-29 | 公開日 | 2006-04-11 | 最終更新日 | 2023-08-23 | 実験手法 | X-RAY DIFFRACTION (1.45 Å) | 主引用文献 | Probing molecular docking in a charged model binding site. J.Mol.Biol., 357, 2006
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2ANZ
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![BU of 2anz by Molmil](/molmil-images/mine/2anz) | cytochrome c peroxidase in complex with 2,6-diaminopyridine | 分子名称: | Cytochrome c peroxidase, mitochondrial, PROTOPORPHYRIN IX CONTAINING FE, ... | 著者 | Brenk, R, Vetter, S.W, Boyce, S.E, Goodin, D.B, Shoichet, B.K. | 登録日 | 2005-08-11 | 公開日 | 2006-04-11 | 最終更新日 | 2023-08-23 | 実験手法 | X-RAY DIFFRACTION (1.75 Å) | 主引用文献 | Probing molecular docking in a charged model binding site. J.Mol.Biol., 357, 2006
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2AS3
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![BU of 2as3 by Molmil](/molmil-images/mine/2as3) | cytochrome c peroxidase in complex with phenol | 分子名称: | Cytochrome c peroxidase, mitochondrial, PHENOL, ... | 著者 | Brenk, R, Vetter, S.W, Boyce, S.E, Goodin, D.B, Shoichet, B.K. | 登録日 | 2005-08-22 | 公開日 | 2006-04-11 | 最終更新日 | 2023-08-23 | 実験手法 | X-RAY DIFFRACTION (1.4 Å) | 主引用文献 | Probing molecular docking in a charged model binding site. J.Mol.Biol., 357, 2006
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2AS6
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![BU of 2as6 by Molmil](/molmil-images/mine/2as6) | cytochrome c peroxidase in complex with cyclopentylamine | 分子名称: | CYCLOPENTANAMINE, Cytochrome c peroxidase, mitochondrial, ... | 著者 | Brenk, R, Vetter, S.W, Boyce, S.E, Goodin, D.B, Shoichet, B.K. | 登録日 | 2005-08-22 | 公開日 | 2006-04-11 | 最終更新日 | 2023-08-23 | 実験手法 | X-RAY DIFFRACTION (1.45 Å) | 主引用文献 | Probing molecular docking in a charged model binding site. J.Mol.Biol., 357, 2006
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2EUQ
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![BU of 2euq by Molmil](/molmil-images/mine/2euq) | Cytochrome c peroxydase (CCP) in complex with 3-thienylmethylamine | 分子名称: | 1-THIEN-3-YLMETHANAMINE, PROTOPORPHYRIN IX CONTAINING FE, cytochrome c peroxidase | 著者 | Brenk, R, Vetter, S.W, Boyce, S.E, Goodin, D.B, Shoichet, B.K. | 登録日 | 2005-10-29 | 公開日 | 2006-04-11 | 最終更新日 | 2023-08-23 | 実験手法 | X-RAY DIFFRACTION (1.3 Å) | 主引用文献 | Probing molecular docking in a charged model binding site. J.Mol.Biol., 357, 2006
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2EUR
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![BU of 2eur by Molmil](/molmil-images/mine/2eur) | Cytochrome c peroxidase (CCP) in complex with 4-pyridylcarbinol | 分子名称: | PROTOPORPHYRIN IX CONTAINING FE, PYRIDIN-4-YLMETHANOL, cytochrome c peroxidase | 著者 | Brenk, R, Vetter, S.W, Boyce, S.E, Goodin, D.B, Shoichet, B.K. | 登録日 | 2005-10-29 | 公開日 | 2006-04-11 | 最終更新日 | 2023-08-23 | 実験手法 | X-RAY DIFFRACTION (1.39 Å) | 主引用文献 | Probing molecular docking in a charged model binding site. J.Mol.Biol., 357, 2006
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2EUS
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![BU of 2eus by Molmil](/molmil-images/mine/2eus) | Cytochrome c peroxidase (CCP) in complex with benzylamine | 分子名称: | BENZYLAMINE, PROTOPORPHYRIN IX CONTAINING FE, cytochrome c peroxidase | 著者 | Brenk, R, Vetter, S.W, Boyce, S.E, Goodin, D.B, Shoichet, B.K. | 登録日 | 2005-10-29 | 公開日 | 2006-04-11 | 最終更新日 | 2023-08-23 | 実験手法 | X-RAY DIFFRACTION (1.55 Å) | 主引用文献 | Probing molecular docking in a charged model binding site. J.Mol.Biol., 357, 2006
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2AS4
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![BU of 2as4 by Molmil](/molmil-images/mine/2as4) | cytochrome c peroxidase in complex with 3-fluorocatechol | 分子名称: | 3-FLUOROBENZENE-1,2-DIOL, Cytochrome c peroxidase, mitochondrial, ... | 著者 | Brenk, R, Vetter, S.W, Boyce, S.E, Goodin, D.B, Shoichet, B.K. | 登録日 | 2005-08-22 | 公開日 | 2006-04-11 | 最終更新日 | 2023-08-23 | 実験手法 | X-RAY DIFFRACTION (1.3 Å) | 主引用文献 | Probing molecular docking in a charged model binding site. J.Mol.Biol., 357, 2006
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2AS1
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![BU of 2as1 by Molmil](/molmil-images/mine/2as1) | cytochrome c peroxidase in complex with thiopheneamidine | 分子名称: | Cytochrome c peroxidase, mitochondrial, PROTOPORPHYRIN IX CONTAINING FE, ... | 著者 | Brenk, R, Vetter, S.W, Boyce, S.E, Goodin, D.B, Shoichet, B.K. | 登録日 | 2005-08-22 | 公開日 | 2006-04-11 | 最終更新日 | 2023-08-23 | 実験手法 | X-RAY DIFFRACTION (1.55 Å) | 主引用文献 | Probing molecular docking in a charged model binding site. J.Mol.Biol., 357, 2006
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2RB2
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![BU of 2rb2 by Molmil](/molmil-images/mine/2rb2) | |
2RBV
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![BU of 2rbv by Molmil](/molmil-images/mine/2rbv) | Cytochrome C Peroxidase in complex with (1-methyl-1h-pyrrol-2-yl)-methylamine | 分子名称: | 1-(1-methyl-1H-pyrrol-2-yl)methanamine, Cytochrome C Peroxidase, PHOSPHATE ION, ... | 著者 | Graves, A.P, Boyce, S.E, Shoichet, B.K. | 登録日 | 2007-09-19 | 公開日 | 2008-03-18 | 最終更新日 | 2023-08-30 | 実験手法 | X-RAY DIFFRACTION (1.39 Å) | 主引用文献 | Rescoring docking hit lists for model cavity sites: predictions and experimental testing. J.Mol.Biol., 377, 2008
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2RBO
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![BU of 2rbo by Molmil](/molmil-images/mine/2rbo) | |
2RC1
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![BU of 2rc1 by Molmil](/molmil-images/mine/2rc1) | Cytochrome C Peroxidase W191G in complex with 2,4,5-trimethyl-3-oxazoline | 分子名称: | (2R,4R,5R)-2,4,5-trimethyl-1,3-oxazolidine, Cytochrome C Peroxidase, PROTOPORPHYRIN IX CONTAINING FE | 著者 | Graves, A.P, Boyce, S.E, Shoichet, B.K. | 登録日 | 2007-09-19 | 公開日 | 2008-04-01 | 最終更新日 | 2023-08-30 | 実験手法 | X-RAY DIFFRACTION (2.49 Å) | 主引用文献 | Rescoring docking hit lists for model cavity sites: predictions and experimental testing. J.Mol.Biol., 377, 2008
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2RAY
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![BU of 2ray by Molmil](/molmil-images/mine/2ray) | |
2RBU
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![BU of 2rbu by Molmil](/molmil-images/mine/2rbu) | |
2RB1
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![BU of 2rb1 by Molmil](/molmil-images/mine/2rb1) | |
2RBT
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![BU of 2rbt by Molmil](/molmil-images/mine/2rbt) | n-methylbenzylamine in complex with Cytochrome C Peroxidase W191G | 分子名称: | (4S)-2-METHYL-2,4-PENTANEDIOL, Cytochrome C Peroxidase, N-methyl-1-phenylmethanamine, ... | 著者 | Graves, A.P, Boyce, S.E, Shoichet, B.K. | 登録日 | 2007-09-19 | 公開日 | 2008-04-01 | 最終更新日 | 2023-08-30 | 実験手法 | X-RAY DIFFRACTION (1.24 Å) | 主引用文献 | Rescoring docking hit lists for model cavity sites: predictions and experimental testing. J.Mol.Biol., 377, 2008
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2RC0
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![BU of 2rc0 by Molmil](/molmil-images/mine/2rc0) | Cytochrome C Peroxidase W191G in complex with 2-imino-4-methylpiperdine | 分子名称: | (4S)-4-methyl-1,4,5,6-tetrahydropyridin-2-amine, Cytochrome C Peroxidase, PHOSPHATE ION, ... | 著者 | Graves, A.P, Boyce, S.E, Shoichet, B.K. | 登録日 | 2007-09-19 | 公開日 | 2008-03-18 | 最終更新日 | 2023-08-30 | 実験手法 | X-RAY DIFFRACTION (1.5 Å) | 主引用文献 | Rescoring docking hit lists for model cavity sites: predictions and experimental testing. J.Mol.Biol., 377, 2008
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2RBW
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![BU of 2rbw by Molmil](/molmil-images/mine/2rbw) | Cytochrome C Peroxidase W191G in complex with 1,2-dimethyl-1h-pyridin-5-amine | 分子名称: | 5-amino-1,2-dimethylpyridinium, Cytochrome C Peroxidase, PHOSPHATE ION, ... | 著者 | Graves, A.P, Boyce, S.E, Shoichet, B.K. | 登録日 | 2007-09-19 | 公開日 | 2008-03-18 | 最終更新日 | 2023-08-30 | 実験手法 | X-RAY DIFFRACTION (1.5 Å) | 主引用文献 | Rescoring docking hit lists for model cavity sites: predictions and experimental testing. J.Mol.Biol., 377, 2008
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