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7QAD
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BU of 7qad by Molmil
Crystal structure of the C-terminal catalytic domain of Plasmodium falciparum CTP:phosphocholine cytidylyltransferase with 1,4-Oxazepane hydrochloride
分子名称: 1,4-oxazepane, Cholinephosphate cytidylyltransferase, Guanidinium
著者Duclovel, C, Gelin, M, Krimm, I, Cerdan, R, Guichou, J.-F.
登録日2021-11-16
公開日2022-11-30
最終更新日2024-01-31
実験手法X-RAY DIFFRACTION (2.11 Å)
主引用文献Crystallographic screening using ultra-low-molecular-weight ligands to guide drug design of PfCCT inhibitors.
To Be Published
7QD3
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BU of 7qd3 by Molmil
Crystal structure of the C-terminal catalytic domain of Plasmodium falciparum CTP:phosphocholine cytidylyltransferase with morpholine
分子名称: Cholinephosphate cytidylyltransferase, morpholine
著者Duclovel, C, Gelin, M, Krimm, I, Cerdan, R, Guichou, J.-F.
登録日2021-11-26
公開日2022-12-14
最終更新日2024-01-31
実験手法X-RAY DIFFRACTION (2.43 Å)
主引用文献Crystallographic screening using ultra-low-molecular-weight ligands to guide drug design of PfCCT inhibitors
To Be Published
7QVO
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BU of 7qvo by Molmil
Crystal structure of the C-terminal catalytic domain of Plasmodium falciparum CTP:phosphocholine cytidylyltransferase with guanidine
分子名称: 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, Cholinephosphate cytidylyltransferase, Guanidinium
著者Duclovel, C, Gelin, M, Krimm, I, Cerdan, R, Guichou, J.-F.
登録日2022-01-22
公開日2023-01-25
最終更新日2024-02-07
実験手法X-RAY DIFFRACTION (1.62 Å)
主引用文献Crystallographic screening using ultra-low-molecular-weight ligands to guide drug design of PfCCT inhibitors
To Be Published
7QVN
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BU of 7qvn by Molmil
Crystal structure of the C-terminal catalytic domain of Plasmodium falciparum CTP:phosphocholine cytidylyltransferase with(1H-pyrazol-5-yl)methanol
分子名称: 1~{H}-pyrazol-5-ylmethanol, Cholinephosphate cytidylyltransferase, Guanidinium
著者Duclovel, C, Gelin, M, Krimm, I, Cerdan, R, Guichou, J.-F.
登録日2022-01-22
公開日2023-01-25
最終更新日2024-02-07
実験手法X-RAY DIFFRACTION (2.21 Å)
主引用文献Crystallographic screening using ultra-low-molecular-weight ligands to guide drug design of PfCCT inhibitors
To Be Published
2RKW
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BU of 2rkw by Molmil
Intermediate position of ATP on its trail to the binding pocket inside the subunit B mutant R416W of the energy converter A1Ao ATP synthase
分子名称: V-type ATP synthase beta chain
著者Kumar, A, Manimekalai, M.S.S, Balakrishna, A.M, Hunke, C, Gruber, G.
登録日2007-10-18
公開日2008-09-09
最終更新日2023-10-25
実験手法X-RAY DIFFRACTION (2.81 Å)
主引用文献Spectroscopic and crystallographic studies of the mutant R416W give insight into the nucleotide binding traits of subunit B of the A1Ao ATP synthase
Proteins, 75, 2009
4YFF
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BU of 4yff by Molmil
TNNI3K complexed with inhibitor 2
分子名称: 3-[(5-bromo-7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]-N-methyl-4-(morpholin-4-yl)benzenesulfonamide, Serine/threonine-protein kinase TNNI3K
著者Shewchuk, L.M, Wang, L, Lawhorn, B.G.
登録日2015-02-25
公開日2015-09-23
最終更新日2024-02-28
実験手法X-RAY DIFFRACTION (3.07 Å)
主引用文献Identification of Purines and 7-Deazapurines as Potent and Selective Type I Inhibitors of Troponin I-Interacting Kinase (TNNI3K).
J.Med.Chem., 58, 2015
3B2Q
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BU of 3b2q by Molmil
Intermediate position of ATP on its trail to the binding pocket inside the subunit B mutant R416W of the energy converter A1Ao ATP synthase
分子名称: 4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDE, ADENOSINE-5'-TRIPHOSPHATE, CITRIC ACID, ...
著者Kumar, A, Manimekalai, M.S.S, Balakrishna, A.M, Hunke, C, Gruber, G.
登録日2007-10-19
公開日2008-09-09
最終更新日2023-11-01
実験手法X-RAY DIFFRACTION (2.1 Å)
主引用文献Spectroscopic and crystallographic studies of the mutant R416W give insight into the nucleotide binding traits of subunit B of the A1Ao ATP synthase
Proteins, 75, 2009
5DQ8
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BU of 5dq8 by Molmil
Crystal structure of human transcription factor TEAD2 in complex with flufenamic acid
分子名称: 2-[[3-(TRIFLUOROMETHYL)PHENYL]AMINO] BENZOIC ACID, Transcriptional enhancer factor TEF-4
著者Han, X, Luo, X.
登録日2015-09-14
公開日2015-11-25
最終更新日2023-09-27
実験手法X-RAY DIFFRACTION (2.305 Å)
主引用文献Targeting the Central Pocket in Human Transcription Factor TEAD as a Potential Cancer Therapeutic Strategy.
Structure, 23, 2015
5E9W
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BU of 5e9w by Molmil
Crystal structure of mRNA cap guanine-N7 methyltransferase obtained by limited proteolysis
分子名称: S-ADENOSYL-L-HOMOCYSTEINE, mRNA cap guanine-N7 methyltransferase
著者Petit, P, Cowling, V.H.
登録日2015-10-15
公開日2016-07-13
最終更新日2024-01-10
実験手法X-RAY DIFFRACTION (2.283 Å)
主引用文献Molecular basis of RNA guanine-7 methyltransferase (RNMT) activation by RAM.
Nucleic Acids Res., 44, 2016
4YGO
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BU of 4ygo by Molmil
Dodecameric structure of spermidine N-acetyltransferase from Vibrio cholerae in intermediate state
分子名称: CALCIUM ION, METHANOL, Spermidine n1-acetyltransferase
著者Filippova, E.V, Minasov, G, Kiryukhina, O, Anderson, W.F, Center for Structural Genomics of Infectious Diseases (CSGID)
登録日2015-02-26
公開日2015-10-07
最終更新日2023-11-29
実験手法X-RAY DIFFRACTION (2.5 Å)
主引用文献Substrate-Induced Allosteric Change in the Quaternary Structure of the Spermidine N-Acetyltransferase SpeG.
J.Mol.Biol., 427, 2015
4YFI
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BU of 4yfi by Molmil
TNNI3K complexed with inhibitor 1
分子名称: N-methyl-3-(9H-purin-6-ylamino)benzenesulfonamide, Serine/threonine-protein kinase TNNI3K
著者Shewchuk, L.M, Wang, L, Lawhorn, B.G.
登録日2015-02-25
公開日2015-09-23
最終更新日2024-02-28
実験手法X-RAY DIFFRACTION (2.7 Å)
主引用文献Identification of Purines and 7-Deazapurines as Potent and Selective Type I Inhibitors of Troponin I-Interacting Kinase (TNNI3K).
J.Med.Chem., 58, 2015
5E9J
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BU of 5e9j by Molmil
Crystal structure of the mRNA cap guanine-N7 methyltransferase - modular lobe (416-456) deletion
分子名称: S-ADENOSYL-L-HOMOCYSTEINE, mRNA cap guanine-N7 methyltransferase,mRNA cap guanine-N7 methyltransferase
著者Petit, P, Cowling, V.H.
登録日2015-10-15
公開日2016-07-13
最終更新日2024-01-10
実験手法X-RAY DIFFRACTION (3.47 Å)
主引用文献Molecular basis of RNA guanine-7 methyltransferase (RNMT) activation by RAM.
Nucleic Acids Res., 44, 2016
5DQE
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BU of 5dqe by Molmil
Crystal structure of human transcription factor TEAD2 in complex with bromo-fenamic acid
分子名称: 2-[(3-bromophenyl)amino]benzoic acid, Transcriptional enhancer factor TEF-4
著者Han, X, Luo, X.
登録日2015-09-14
公開日2015-11-25
最終更新日2023-09-27
実験手法X-RAY DIFFRACTION (2.183 Å)
主引用文献Targeting the Central Pocket in Human Transcription Factor TEAD as a Potential Cancer Therapeutic Strategy.
Structure, 23, 2015
5E8J
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BU of 5e8j by Molmil
Crystal structure of mRNA cap guanine-N7 methyltransferase in complex with RAM
分子名称: GLYCEROL, RNMT-activating mini protein, S-ADENOSYL-L-HOMOCYSTEINE, ...
著者Petit, P, Cowling, V.
登録日2015-10-14
公開日2016-07-13
最終更新日2024-01-10
実験手法X-RAY DIFFRACTION (2.35 Å)
主引用文献Molecular basis of RNA guanine-7 methyltransferase (RNMT) activation by RAM.
Nucleic Acids Res., 44, 2016
6E74
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BU of 6e74 by Molmil
Structure of Human Transthyretin Leu55Pro Mutant in Complex with Tafamidis
分子名称: 2-(3,5-dichlorophenyl)-1,3-benzoxazole-6-carboxylic acid, Transthyretin
著者Saelices, L, Chung, K, Sawaya, M.R, Cascio, D, Eisenberg, D.
登録日2018-07-25
公開日2019-07-31
最終更新日2024-03-13
実験手法X-RAY DIFFRACTION (1.6 Å)
主引用文献Structural Variants of Transthyretin
To Be Published
6E72
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BU of 6e72 by Molmil
Structure of Human Transthyretin Val30Met Mutant in Complex with Tafamidis
分子名称: 2-(3,5-dichlorophenyl)-1,3-benzoxazole-6-carboxylic acid, Transthyretin
著者Chung, K, Saelices, L, Sawaya, M.R, Cascio, D, Eisenberg, D.
登録日2018-07-25
公開日2019-07-31
最終更新日2019-12-18
実験手法X-RAY DIFFRACTION (1.45 Å)
主引用文献Structural Variants of Transthyretin
To Be Published
6E71
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BU of 6e71 by Molmil
Structure of Human Transthyretin Val30Met/Thr119Met Mutant
分子名称: DI(HYDROXYETHYL)ETHER, Transthyretin
著者Saelices, L, Chung, K, Sawaya, M.R, Cascio, D, Eisenberg, D.
登録日2018-07-25
公開日2019-07-31
最終更新日2024-03-13
実験手法X-RAY DIFFRACTION (1.5 Å)
主引用文献Structural Variants of Transthyretin
To Be Published
6E78
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BU of 6e78 by Molmil
Structure of Human Transthyretin Asp38Ala Mutant in Complex with Diflunisal
分子名称: 5-(2,4-DIFLUOROPHENYL)-2-HYDROXY-BENZOIC ACID, Transthyretin
著者Chung, K, Saelices, L, Sawaya, M.R, Cascio, D, Eisenberg, D.
登録日2018-07-25
公開日2019-07-31
最終更新日2019-12-18
実験手法X-RAY DIFFRACTION (1.499 Å)
主引用文献Structural Variants of Transthyretin
To Be Published
1GTP
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BU of 1gtp by Molmil
GTP CYCLOHYDROLASE I
分子名称: GTP CYCLOHYDROLASE I, SULFATE ION
著者Nar, H, Huber, R, Meining, W, Bacher, A.
登録日1995-09-16
公開日1996-11-08
最終更新日2011-07-13
実験手法X-RAY DIFFRACTION (3 Å)
主引用文献Atomic structure of GTP cyclohydrolase I.
Structure, 3, 1995
6RVZ
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BU of 6rvz by Molmil
Crystal structure of ANGEL2, a 2',3'-cyclic phosphatase, in complex with adenosine-2',3'-vanadate
分子名称: ADENOSINE, MAGNESIUM ION, POTASSIUM ION, ...
著者Kroupova, A, Jinek, M.
登録日2019-06-03
公開日2020-05-20
最終更新日2024-05-01
実験手法X-RAY DIFFRACTION (2.1 Å)
主引用文献ANGEL2 is a member of the CCR4 family of deadenylases with 2',3'-cyclic phosphatase activity.
Science, 369, 2020
6E70
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BU of 6e70 by Molmil
Structure of Wild Type Human Transthyretin in Complex with Diflunisal
分子名称: 5-(2,4-DIFLUOROPHENYL)-2-HYDROXY-BENZOIC ACID, CALCIUM ION, Transthyretin
著者Chung, K, Saelices, L, Sawaya, M.R, Cascio, D, Eisenberg, D.
登録日2018-07-25
公開日2019-07-31
最終更新日2024-03-13
実験手法X-RAY DIFFRACTION (1.992 Å)
主引用文献Structural Variants of Transthyretin
To Be Published
6E76
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BU of 6e76 by Molmil
Structure of Human Transthyretin Asp38Ala/Thr119Met Mutant
分子名称: ACETATE ION, GLYCEROL, SULFATE ION, ...
著者Saelices, L, Chung, K, Sawaya, M.R, Cascio, D, Eisenberg, D.
登録日2018-07-25
公開日2019-07-31
最終更新日2019-12-18
実験手法X-RAY DIFFRACTION (1.6 Å)
主引用文献Structural Variants of Transthyretin
To Be Published
6RW0
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BU of 6rw0 by Molmil
Crystal structure of ANGEL2, a 2',3'-cyclic phosphatase
分子名称: GLYCEROL, MAGNESIUM ION, POTASSIUM ION, ...
著者Kroupova, A, Jinek, M.
登録日2019-06-03
公開日2020-05-20
最終更新日2024-01-24
実験手法X-RAY DIFFRACTION (1.45 Å)
主引用文献ANGEL2 is a member of the CCR4 family of deadenylases with 2',3'-cyclic phosphatase activity.
Science, 369, 2020
7XYV
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BU of 7xyv by Molmil
Crystal structure of ZYG11B bound to SFLH degron
分子名称: Protein zyg-11 homolog B
著者Dong, C, Yan, X, Li, Y.
登録日2022-06-02
公開日2022-12-21
最終更新日2023-11-29
実験手法X-RAY DIFFRACTION (2.52 Å)
主引用文献CRL2 ZER1/ZYG11B recognizes small N-terminal residues for degradation.
Nat Commun, 13, 2022
7XYW
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Crystal structure of ZYG11B bound to AFLH degron
分子名称: Protein zyg-11 homolog B
著者Dong, C, Yan, X, Li, Y.
登録日2022-06-02
公開日2022-12-21
最終更新日2023-11-29
実験手法X-RAY DIFFRACTION (2.5 Å)
主引用文献CRL2 ZER1/ZYG11B recognizes small N-terminal residues for degradation.
Nat Commun, 13, 2022

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