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1EP3
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CRYSTAL STRUCTURE OF LACTOCOCCUS LACTIS DIHYDROOROTATE DEHYDROGENASE B. DATA COLLECTED UNDER CRYOGENIC CONDITIONS.
分子名称:DIHYDROOROTATE DEHYDROGENASE B (PYRD SUBUNIT), DIHYDROOROTATE DEHYDROGENASE B (PYRK SUBUNIT), FLAVIN MONONUCLEOTIDE, ...
著者Rowland, P., Norager, S., Jensen, K.F., Larsen, S.
登録日2000-03-27
公開日2001-01-17
最終更新日2011-07-13
実験手法X-RAY DIFFRACTION (2.1 Å)
主引用文献Structure of dihydroorotate dehydrogenase B: electron transfer between two flavin groups bridged by an iron-sulphur cluster.
Structure Fold.Des., 8, 2000
1DOR
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DIHYDROOROTATE DEHYDROGENASE A FROM LACTOCOCCUS LACTIS
分子名称:DIHYDROOROTATE DEHYDROGENASE A, FLAVIN MONONUCLEOTIDE
著者Rowland, P., Larsen, S.
登録日1997-01-14
公開日1997-04-21
最終更新日2011-07-13
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献The crystal structure of the flavin containing enzyme dihydroorotate dehydrogenase A from Lactococcus lactis.
Structure, 5, 1997
1EP1
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CRYSTAL STRUCTURE OF LACTOCOCCUS LACTIS DIHYDROOROTATE DEHYDROGENASE B
分子名称:DIHYDROOROTATE DEHYDROGENASE B (PYRD SUBUNIT), DIHYDROOROTATE DEHYDROGENASE B (PYRK SUBUNIT), FLAVIN MONONUCLEOTIDE, ...
著者Rowland, P., Norager, S., Jensen, K.F., Larsen, S.
登録日2000-03-27
公開日2001-01-17
最終更新日2011-07-13
実験手法X-RAY DIFFRACTION (2.2 Å)
主引用文献Structure of dihydroorotate dehydrogenase B: electron transfer between two flavin groups bridged by an iron-sulphur cluster.
Structure Fold.Des., 8, 2000
1EP2
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CRYSTAL STRUCTURE OF LACTOCOCCUS LACTIS DIHYDROOROTATE DEHYDROGENASE B COMPLEXED WITH OROTATE
分子名称:DIHYDROOROTATE DEHYDROGENASE B (PYRD SUBUNIT), DIHYDROOROTATE DEHYDROGENASE B (PYRK SUBUNIT), FLAVIN MONONUCLEOTIDE, ...
著者Rowland, P., Norager, S., Jensen, K.F., Larsen, S.
登録日2000-03-27
公開日2001-01-17
最終更新日2011-07-13
実験手法X-RAY DIFFRACTION (2.4 Å)
主引用文献Structure of dihydroorotate dehydrogenase B: electron transfer between two flavin groups bridged by an iron-sulphur cluster.
Structure Fold.Des., 8, 2000
2DOR
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DIHYDROOROTATE DEHYDROGENASE A FROM LACTOCOCCUS LACTIS COMPLEXED WITH OROTATE
分子名称:DIHYDROOROTATE DEHYDROGENASE A, FLAVIN MONONUCLEOTIDE, OROTIC ACID
著者Rowland, P., Larsen, S.
登録日1998-05-11
公開日1998-08-12
最終更新日2011-07-13
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献The crystal structure of Lactococcus lactis dihydroorotate dehydrogenase A complexed with the enzyme reaction product throws light on its enzymatic function.
Protein Sci., 7, 1998
2F9Q
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CRYSTAL STRUCTURE OF HUMAN CYTOCHROME P450 2D6
分子名称:Cytochrome P450 2D6, PROTOPORPHYRIN IX CONTAINING FE, SULFATE ION
著者Rowland, P.
登録日2005-12-06
公開日2005-12-20
最終更新日2011-07-13
実験手法X-RAY DIFFRACTION (3.002 Å)
主引用文献Crystal Structure of Human Cytochrome P450 2D6
J.Biol.Chem., 281, 2006
1DPG
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GLUCOSE 6-PHOSPHATE DEHYDROGENASE FROM LEUCONOSTOC MESENTEROIDES
分子名称:GLUCOSE 6-PHOSPHATE DEHYDROGENASE, PHOSPHATE ION
著者Adams, M.J., Rowland, P., Gover, S.
登録日1995-12-04
公開日1996-03-08
最終更新日2011-07-13
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献The three-dimensional structure of glucose 6-phosphate dehydrogenase from Leuconostoc mesenteroides refined at 2.0 A resolution.
Structure, 2, 1994
6QM7
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LEISHMANIA TARENTOLAE PROTEASOME 20S SUBUNIT COMPLEXED WITH GSK3494245
分子名称:Proteasome alpha1 chain, Proteasome alpha2 chain, Proteasome alpha3 chain, ...
著者Rowland, P., Goswami, P.
登録日2019-02-01
公開日2019-04-17
最終更新日2019-05-22
実験手法ELECTRON MICROSCOPY (2.8 Å)
主引用文献Preclinical candidate for the treatment of visceral leishmaniasis that acts through proteasome inhibition.
Proc.Natl.Acad.Sci.USA, 116, 2019
6QM8
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LEISHMANIA TARENTOLAE PROTEASOME 20S SUBUNIT APO STRUCTURE
分子名称:Proteasome alpha1 chain, Proteasome alpha2 chain, Proteasome alpha3 chain, ...
著者Rowland, P., Goswami, P.
登録日2019-02-01
公開日2019-04-17
最終更新日2019-05-22
実験手法ELECTRON MICROSCOPY (3.3 Å)
主引用文献Preclinical candidate for the treatment of visceral leishmaniasis that acts through proteasome inhibition.
Proc.Natl.Acad.Sci.USA, 116, 2019
5NA5
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PSEUDOMONAS FLUORESCENS KYNURENINE 3-MONOOXYGENASE (KMO) APO STRUCTURE
分子名称:Kynurenine 3-monooxygenase, FLAVIN-ADENINE DINUCLEOTIDE, CHLORIDE ION, ...
著者Rowland, P.
登録日2017-02-27
公開日2017-06-21
実験手法X-RAY DIFFRACTION (1.94 Å)
主引用文献Structural and mechanistic basis of differentiated inhibitors of the acute pancreatitis target kynurenine-3-monooxygenase.
Nat Commun, 8, 2017
5NAB
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PSEUDOMONAS FLUORESCENS KYNURENINE 3-MONOOXYGENASE (KMO) IN COMPLEX WITH 3-(5-CHLORO-6-METHYL-2-OXO-2,3-DIHYDRO-1,3-BENZOXAZOL-3-YL)PROPANOIC ACID
分子名称:Kynurenine 3-monooxygenase, FLAVIN-ADENINE DINUCLEOTIDE, CHLORIDE ION, ...
著者Rowland, P.
登録日2017-02-27
公開日2017-06-21
実験手法X-RAY DIFFRACTION (1.63 Å)
主引用文献Structural and mechanistic basis of differentiated inhibitors of the acute pancreatitis target kynurenine-3-monooxygenase.
Nat Commun, 8, 2017
5NAE
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PSEUDOMONAS FLUORESCENS KYNURENINE 3-MONOOXYGENASE (KMO) IN COMPLEX WITH 3-{5-CHLORO-2-OXO-6-[(1R)-1-(PYRIDIN-2-YL)ETHOXY]-2,3-DIHYDRO-1,3-BENZOXAZOL-3-YL}PROPANOIC ACID
分子名称:Kynurenine 3-monooxygenase, FLAVIN-ADENINE DINUCLEOTIDE, 3-[5-chloranyl-2-oxidanylidene-6-[(1~{R})-1-pyridin-2-ylethoxy]-1,3-benzoxazol-3-yl]propanoic acid
著者Rowland, P.
登録日2017-02-27
公開日2017-06-21
実験手法X-RAY DIFFRACTION (1.76 Å)
主引用文献Structural and mechanistic basis of differentiated inhibitors of the acute pancreatitis target kynurenine-3-monooxygenase.
Nat Commun, 8, 2017
5NAG
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PSEUDOMONAS FLUORESCENS KYNURENINE 3-MONOOXYGENASE (KMO) IN COMPLEX WITH 3-{5-CHLORO-6-[(1R)-1-(PYRIDIN-2-YL)ETHOXY]-1,2-BENZOXAZOL-3-YL}PROPANOIC ACID
分子名称:Kynurenine 3-monooxygenase, FLAVIN-ADENINE DINUCLEOTIDE, 3-[5-chloranyl-6-[(1~{R})-1-pyridin-2-ylethoxy]-1,2-benzoxazol-3-yl]propanoic acid
著者Rowland, P.
登録日2017-02-27
公開日2017-06-21
実験手法X-RAY DIFFRACTION (1.68 Å)
主引用文献Structural and mechanistic basis of differentiated inhibitors of the acute pancreatitis target kynurenine-3-monooxygenase.
Nat Commun, 8, 2017
5NAH
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PSEUDOMONAS FLUORESCENS KYNURENINE 3-MONOOXYGENASE (KMO) IN COMPLEX WITH 3-{5-CHLORO-6-[(1R)-1-(6-METHYLPYRIDAZIN-3-YL)ETHOXY]-1,2-BENZOXAZOL-3-YL}PROPANOIC ACID
分子名称:Kynurenine 3-monooxygenase, FLAVIN-ADENINE DINUCLEOTIDE, 3-[5-chloranyl-6-[(1~{R})-1-(6-methylpyridazin-3-yl)ethoxy]-1,2-benzoxazol-3-yl]propanoic acid
著者Rowland, P.
登録日2017-02-27
公開日2017-06-21
最終更新日2017-07-19
実験手法X-RAY DIFFRACTION (1.75 Å)
主引用文献Structural and mechanistic basis of differentiated inhibitors of the acute pancreatitis target kynurenine-3-monooxygenase.
Nat Commun, 8, 2017
2O0U
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CRYSTAL STRUCTURE OF HUMAN JNK3 COMPLEXED WITH N-{3-CYANO-6-[3-(1-PIPERIDINYL)PROPANOYL]-4,5,6,7-TETRAHYDROTHIENO[2,3-C]PYRIDIN-2-YL}-1-NAPHTHALENECARBOXAMIDE
分子名称:Mitogen-activated protein kinase 10, N-{3-CYANO-6-[3-(1-PIPERIDINYL)PROPANOYL]-4,5,6,7-TETRAHYDROTHIENO[2,3-C]PYRIDIN-2-YL}1-NAPHTHALENECARBOXAMIDE
著者Rowland, P., Somers, D.
登録日2006-11-28
公開日2007-02-27
最終更新日2017-10-18
実験手法X-RAY DIFFRACTION (2.1 Å)
主引用文献N-(3-Cyano-4,5,6,7-tetrahydro-1-benzothien-2-yl)amides as potent, selective, inhibitors of JNK2 and JNK3.
Bioorg.Med.Chem.Lett., 17, 2007
4CQ8
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PLASMODIUM FALCIPARUM DIHYDROOROTATE DEHYDROGENASE (DHODH) IN COMPLEX WITH GENZ-669178
分子名称:DIHYDROOROTATE DEHYDROGENASE, FLAVIN MONONUCLEOTIDE, OROTIC ACID, ...
著者Rowland, P.
登録日2014-02-12
公開日2014-04-30
最終更新日2019-05-08
実験手法X-RAY DIFFRACTION (1.98 Å)
主引用文献In Vitro Resistance Selections for Plasmodium Falciparum Dihydroorotate Dehydrogenase Inhibitors Give Mutants with Multiple Point Mutations in the Drug-Binding Site and Altered Growth.
J.Biol.Chem., 289, 2014
4CQ9
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PLASMODIUM FALCIPARUM DIHYDROOROTATE DEHYDROGENASE (DHODH) IN COMPLEX WITH IDI-6253
分子名称:DIHYDROOROTATE DEHYDROGENASE, FLAVIN MONONUCLEOTIDE, OROTIC ACID, ...
著者Rowland, P.
登録日2014-02-12
公開日2014-04-30
最終更新日2019-05-08
実験手法X-RAY DIFFRACTION (2.72 Å)
主引用文献In Vitro Resistance Selections for Plasmodium Falciparum Dihydroorotate Dehydrogenase Inhibitors Give Mutants with Multiple Point Mutations in the Drug-Binding Site and Altered Growth.
J.Biol.Chem., 289, 2014
4CQA
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PLASMODIUM FALCIPARUM DIHYDROOROTATE DEHYDROGENASE (DHODH) IN COMPLEX WITH IDI-6273
分子名称:DIHYDROOROTATE DEHYDROGENASE, FLAVIN MONONUCLEOTIDE, OROTIC ACID, ...
著者Rowland, P.
登録日2014-02-12
公開日2014-04-30
最終更新日2019-05-08
実験手法X-RAY DIFFRACTION (2.82 Å)
主引用文献In Vitro Resistance Selections for Plasmodium Falciparum Dihydroorotate Dehydrogenase Inhibitors Give Mutants with Multiple Point Mutations in the Drug-Binding Site and Altered Growth.
J.Biol.Chem., 289, 2014
5L72
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PI3 KINASE DELTA IN COMPLEX WITH N-[6-(5-METHANESULFONAMIDO-6-METHOXYPYRIDIN-3-YL)-1,3-DIHYDRO-2-BENZOFURAN-4-YL]-2-(MORPHOLIN-4-YL)ACETAMIDE
分子名称:Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform, N-[6-(5-methanesulfonamido-6-methoxypyridin-3-yl)-1,3-dihydro-2-benzofuran-4-yl]-2-(morpholin-4-yl)acetamide
著者Rowland, P.
登録日2016-06-01
公開日2016-07-27
最終更新日2016-08-24
実験手法X-RAY DIFFRACTION (3.06 Å)
主引用文献Evolution of a Novel, Orally Bioavailable Series of PI3K delta Inhibitors from an Inhaled Lead for the Treatment of Respiratory Disease.
J.Med.Chem., 59, 2016
5MZC
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PSEUDOMONAS FLUORESCENS KYNURENINE 3-MONOOXYGENASE (KMO) IN COMPLEX WITH 3-(5-CHLORO-6-ETHOXY-2-OXO-2,3-DIHYDRO-1,3-BENZOXAZOL-3-YL)PROPANOIC ACID
分子名称:Kynurenine 3-monooxygenase, FLAVIN-ADENINE DINUCLEOTIDE, CHLORIDE ION, ...
著者Rowland, P.
登録日2017-01-31
公開日2017-04-19
最終更新日2017-05-10
実験手法X-RAY DIFFRACTION (1.82 Å)
主引用文献Development of a Series of Kynurenine 3-Monooxygenase Inhibitors Leading to a Clinical Candidate for the Treatment of Acute Pancreatitis.
J. Med. Chem., 60, 2017
5MZI
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PSEUDOMONAS FLUORESCENS KYNURENINE 3-MONOOXYGENASE (KMO) IN COMPLEX WITH 3-(5-CHLORO-6-CYCLOPROPOXY-2-OXO-2,3-DIHYDRO-1,3-BENZOXAZOL-3-YL)PROPANOIC ACID
分子名称:Kynurenine 3-monooxygenase, FLAVIN-ADENINE DINUCLEOTIDE, CHLORIDE ION, ...
著者Rowland, P.
登録日2017-01-31
公開日2017-04-19
最終更新日2017-05-10
実験手法X-RAY DIFFRACTION (1.71 Å)
主引用文献Development of a Series of Kynurenine 3-Monooxygenase Inhibitors Leading to a Clinical Candidate for the Treatment of Acute Pancreatitis.
J. Med. Chem., 60, 2017
5MZK
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PSEUDOMONAS FLUORESCENS KYNURENINE 3-MONOOXYGENASE (KMO) IN COMPLEX WITH 3-[5-CHLORO-6-(CYCLOBUTYLMETHOXY)-2-OXO-2,3-DIHYDRO-1,3-BENZOXAZOL-3-YL]PROPANOIC ACID
分子名称:Kynurenine 3-monooxygenase, FLAVIN-ADENINE DINUCLEOTIDE, CHLORIDE ION, ...
著者Rowland, P.
登録日2017-01-31
公開日2017-04-19
最終更新日2017-05-10
実験手法X-RAY DIFFRACTION (1.82 Å)
主引用文献Development of a Series of Kynurenine 3-Monooxygenase Inhibitors Leading to a Clinical Candidate for the Treatment of Acute Pancreatitis.
J. Med. Chem., 60, 2017
5N7T
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PSEUDOMONAS FLUORESCENS KYNURENINE 3-MONOOXYGENASE (KMO) IN COMPLEX WITH 3-(5,6-DICHLORO-2-OXO-2,3-DIHYDRO-1,3-BENZOXAZOL-3-YL)PROPANOIC ACID
分子名称:Kynurenine 3-monooxygenase, FLAVIN-ADENINE DINUCLEOTIDE, CHLORIDE ION, ...
著者Rowland, P.
登録日2017-02-21
公開日2017-06-14
実験手法X-RAY DIFFRACTION (1.81 Å)
主引用文献The discovery of potent and selective kynurenine 3-monooxygenase inhibitors for the treatment of acute pancreatitis.
Bioorg. Med. Chem. Lett., 27, 2017
6GJG
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PLASMODIUM FALCIPARUM DIHYDROOROTATE DEHYDROGENASE DHODH IN COMPLEX WITH 3,6-DIMETHYL-N-(4-(TRIFLUOROMETHYL)PHENYL)-(1,2)OXAZOLO(5,4-D)PYRIMIDIN-4-AMINE
分子名称:Dihydroorotate dehydrogenase (quinone), mitochondrial, FLAVIN MONONUCLEOTIDE, ...
著者Rowland, P.
登録日2018-05-16
公開日2018-09-19
実験手法X-RAY DIFFRACTION (1.99 Å)
主引用文献Isoxazolopyrimidine-Based Inhibitors ofPlasmodium falciparumDihydroorotate Dehydrogenase with Antimalarial Activity.
ACS Omega, 3, 2018
2VIJ
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HUMAN BACE-1 IN COMPLEX WITH 3-(1,1-DIOXIDOTETRAHYDRO-2H-1,2-THIAZIN- 2-YL)-5-(ETHYLAMINO)-N-((1S,2R)-2-HYDROXY-1-(PHENYLMETHYL)-3-(1,2,3,4- TETRAHYDRO-1-NAPHTHALENYLAMINO)PROPYL)BENZAMIDE
分子名称:BETA-SECRETASE 1, N-{(1S,2R)-1-benzyl-2-hydroxy-3-[(1S)-1,2,3,4-tetrahydronaphthalen-1-ylamino]propyl}-3-(1,1-dioxido-1,2-thiazinan-2-yl)-5-(ethylamino)benzamide
著者Beswick, P., Charrier, N., Clarke, B., Demont, E., Dingwall, C., Dunsdon, R., Faller, A., Gleave, R., Hawkins, J., Hussain, I., Johnson, C.N., Macpherson, D., Maile, G., Matico, R., Milner, P., Mosley, J., Naylor, A., O'Brien, A., Redshaw, S., Riddell, D., Rowland, P., Skidmore, J., Soleil, V., Smith, K.J., Stanway, S., Stemp, G., Stuart, A., Sweitzer, S., Theobald, P., Vesey, D., Walter, D.S., Ward, J., Wayne, G.
登録日2007-12-04
公開日2008-01-29
最終更新日2019-05-15
実験手法X-RAY DIFFRACTION (1.6 Å)
主引用文献Bace-1 Inhibitors Part 3: Identification of Hydroxy Ethylamines (Heas) with Nanomolar Potency in Cells.
Bioorg.Med.Chem.Lett., 18, 2008