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4WMZ	S. cerevisiae CYP51 complexed with fluconazole in the active site Descriptor: 2-(2,4-DIFLUOROPHENYL)-1,3-DI(1H-1,2,4-TRIAZOL-1-YL)PROPAN-2-OL, Lanosterol 14-alpha demethylase, PROTOPORPHYRIN IX CONTAINING FE Authors: Sagatova, A, Keniya, M.V, Wilson, R, Wilbanks, S.M, Monk, B.C, Tyndall, J.D.A. Deposit date: 2014-10-09 Release date: 2015-07-01 Last modified: 2023-09-27 Method: X-RAY DIFFRACTION (2.05 Å) Cite: Structural Insights into Binding of the Antifungal Drug Fluconazole to Saccharomyces cerevisiae Lanosterol 14 alpha-Demethylase. Antimicrob.Agents Chemother., 59, 2015
4WNU	Human Cytochrome P450 2D6 Quinidine Complex Descriptor: Cytochrome P450 2D6, DIMETHYL SULFOXIDE, GLYCEROL, ... Authors: Wang, A, Stout, C.D, Johnson, E.F. Deposit date: 2014-10-14 Release date: 2015-01-14 Last modified: 2023-09-27 Method: X-RAY DIFFRACTION (2.26 Å) Cite: Contributions of Ionic Interactions and Protein Dynamics to Cytochrome P450 2D6 (CYP2D6) Substrate and Inhibitor Binding. J.Biol.Chem., 290, 2015
4WQJ	Crystal Structure of CYP119 from Sulfolobus acidocaldarius, Collected at 298K and Complexed with 4-(4-bromophenyl)-1H imidazole Descriptor: 4-(4-bromophenyl)-1H-imidazole, Cytochrome P450 119, GLYCEROL, ... Authors: Madrona, Y. Deposit date: 2014-10-22 Release date: 2015-02-18 Last modified: 2023-12-27 Method: X-RAY DIFFRACTION (2.7 Å) Cite: TWO DIMENSIONAL NMR AND X-RAY ANALYSIS OF CYP119 LIGAND-DEPENDENT CONFORMATIONAL DYNAMICS. To Be Published
1CMJ	CRYSTAL STRUCTURES OF FERRIC-NO COMPLEXES OF FUNGAL NITRIC OXIDE REDUCTASE AND THEIR SER286 MUTANTS AT CRYOGENIC TEMPERATURE Descriptor: CYTOCHROME P450, NITRIC OXIDE, PROTOPORPHYRIN IX CONTAINING FE Authors: Park, S.-Y, Shiro, Y. Deposit date: 1999-05-07 Release date: 2000-03-22 Last modified: 2023-08-09 Method: X-RAY DIFFRACTION (1.7 Å) Cite: Proton delivery in NO reduction by fungal nitric-oxide reductase. Cryogenic crystallography, spectroscopy, and kinetics of ferric-NO complexes of wild-type and mutant enzymes. J.Biol.Chem., 275, 2000
4XE3	OleP, the cytochrome P450 epoxidase from Streptomyces antibioticus involved in Oleandomycin biosynthesis: functional analysis and crystallographic structure in complex with clotrimazole. Descriptor: 1-[(2-CHLOROPHENYL)(DIPHENYL)METHYL]-1H-IMIDAZOLE, Cytochrome P-450, PROTOPORPHYRIN IX CONTAINING FE, ... Authors: Montemiglio, L.C, Parisi, G, Scaglione, A, Savino, C, Vallone, B. Deposit date: 2014-12-22 Release date: 2015-11-04 Last modified: 2023-09-27 Method: X-RAY DIFFRACTION (2.65 Å) Cite: Functional analysis and crystallographic structure of clotrimazole bound OleP, a cytochrome P450 epoxidase from Streptomyces antibioticus involved in oleandomycin biosynthesis. Biochim.Biophys.Acta, 1860, 2015
1CL6	CRYSTAL STRUCTURES OF FERRIC-NO COMPLEXES OF FUNGAL NITRIC OXIDE REDUCTASE AND ITS SER286 MUTANTS AT CRYOGENIC TEMPERATURE Descriptor: CYTOCHROME P450, NITRIC OXIDE, PROTOPORPHYRIN IX CONTAINING FE Authors: Park, S.-Y, Shiro, Y. Deposit date: 1999-05-06 Release date: 2000-03-22 Last modified: 2023-08-09 Method: X-RAY DIFFRACTION (1.7 Å) Cite: Proton delivery in NO reduction by fungal nitric-oxide reductase. Cryogenic crystallography, spectroscopy, and kinetics of ferric-NO complexes of wild-type and mutant enzymes. J.Biol.Chem., 275, 2000
1CP4	FORMATION, CRYSTAL STRUCTURE, AND REARRANGEMENT OF A CYTOCHROME P450-CAM IRON-PHENYL COMPLEX Descriptor: BENZENE, CYTOCHROME P450-CAM, PROTOPORPHYRIN IX CONTAINING FE Authors: Raag, R, Poulos, T.L. Deposit date: 1991-06-04 Release date: 1993-01-15 Last modified: 2024-02-07 Method: X-RAY DIFFRACTION (1.9 Å) Cite: Formation, crystal structure, and rearrangement of a cytochrome P-450cam iron-phenyl complex. Biochemistry, 29, 1990
4XRY	Human Cytochrome P450 2D6 BACE1 Inhibitor 5 Complex Descriptor: (4aR,6R,8aS)-8a-(2,4-difluorophenyl)-6-(1-methyl-1H-pyrazol-4-yl)-4,4a,5,6,8,8a-hexahydropyrano[3,4-d][1,3]thiazin-2-amine, Cytochrome P450 2D6, PROTOPORPHYRIN IX CONTAINING FE, ... Authors: Johnson, E.F, Fan, Y. Deposit date: 2015-01-21 Release date: 2015-05-20 Last modified: 2023-09-27 Method: X-RAY DIFFRACTION (2.5 Å) Cite: Utilizing Structures of CYP2D6 and BACE1 Complexes To Reduce Risk of Drug-Drug Interactions with a Novel Series of Centrally Efficacious BACE1 Inhibitors. J.Med.Chem., 58, 2015
1CMN	CRYSTAL STRUCTURES OF FERRIC-NO COMPLEXES OF FUNGAL NITRIC OXIDE REDUCTASE AND THEIR SER286 MUTANTS AT CRYOGENIC TEMPERATURE Descriptor: CYTOCHROME P450, NITRIC OXIDE, PROTOPORPHYRIN IX CONTAINING FE Authors: Park, S.-Y, Shiro, Y. Deposit date: 1999-05-07 Release date: 2000-03-22 Last modified: 2023-08-09 Method: X-RAY DIFFRACTION (1.7 Å) Cite: Proton delivery in NO reduction by fungal nitric-oxide reductase. Cryogenic crystallography, spectroscopy, and kinetics of ferric-NO complexes of wild-type and mutant enzymes. J.Biol.Chem., 275, 2000
1CPT	CRYSTAL STRUCTURE AND REFINEMENT OF CYTOCHROME P450-TERP AT 2.3 ANGSTROMS RESOLUTION Descriptor: CYTOCHROME P450-TERP, PROTOPORPHYRIN IX CONTAINING FE Authors: Hasemann, C.A, Ravichandran, K.G, Peterson, J.A, Deisenhofer, J. Deposit date: 1993-11-23 Release date: 1994-01-31 Last modified: 2024-02-07 Method: X-RAY DIFFRACTION (2.3 Å) Cite: Crystal structure and refinement of cytochrome P450terp at 2.3 A resolution. J.Mol.Biol., 236, 1994
4XRZ	Human Cytochrome P450 2D6 BACE1 Inhibitor 6 Complex Descriptor: (4aR,6R,8aS)-8a-(2,4-difluorophenyl)-6-(1H-pyrazol-4-yl)-4,4a,5,6,8,8a-hexahydropyrano[3,4-d][1,3]thiazin-2-amine, Cytochrome P450 2D6, GLYCEROL, ... Authors: Johnson, E.F, Fan, Y. Deposit date: 2015-01-21 Release date: 2015-05-20 Last modified: 2023-09-27 Method: X-RAY DIFFRACTION (2.4 Å) Cite: Utilizing Structures of CYP2D6 and BACE1 Complexes To Reduce Risk of Drug-Drug Interactions with a Novel Series of Centrally Efficacious BACE1 Inhibitors. J.Med.Chem., 58, 2015
1DZ8	oxygen complex of p450cam from pseudomonas putida Descriptor: 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, CAMPHOR, CYTOCHROME P450-CAM, ... Authors: Schlichting, I, Berendzen, J, Chu, K, Stock, A.M, Maves, S.A, Benson, D.E, Sweet, R.M, Ringe, D, Petsko, G.A, Sligar, S.G. Deposit date: 2000-02-18 Release date: 2000-03-31 Last modified: 2019-04-03 Method: X-RAY DIFFRACTION (1.9 Å) Cite: The Catalytic Pathway of Cytochrome P450Cam at Atomic Resolution Science, 287, 2000
1DT6	STRUCTURE OF MAMMALIAN CYTOCHROME P450 2C5 Descriptor: CYTOCHROME P450 2C5, PROTOPORPHYRIN IX CONTAINING FE, SAMARIUM (III) ION, ... Authors: Williams, P.A, Cosme, J, Sridhar, V, Johnson, E.F, McRee, D.E. Deposit date: 2000-01-11 Release date: 2000-09-27 Last modified: 2021-11-03 Method: X-RAY DIFFRACTION (3 Å) Cite: Mammalian microsomal cytochrome P450 monooxygenase: structural adaptations for membrane binding and functional diversity. Mol.Cell, 5, 2000
1DZ4	ferric p450cam from pseudomonas putida Descriptor: 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, CAMPHOR, CYTOCHROME P450-CAM, ... Authors: Schlichting, I, Berendzen, J, Chu, K, Stock, A.M, Maves, S.A, Benson, D.E, Sweet, R.M, Ringe, D, Petsko, G.A, Sligar, S.G. Deposit date: 2000-02-16 Release date: 2000-07-20 Last modified: 2019-07-24 Method: X-RAY DIFFRACTION (1.6 Å) Cite: The Catalytic Pathway of Cytochrome P450Cam at Atomic Resolution Science, 287, 2000
1DZ9	Putative oxo complex of P450cam from Pseudomonas putida Descriptor: 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, CAMPHOR, CYTOCHROME P450-CAM, ... Authors: Schlichting, I, Berendzen, J, Chu, K, Stock, A.M, Maves, S.A, Benson, D.E, Sweet, R.M, Ringe, D, Petsko, G.A, Sligar, S.G. Deposit date: 2000-02-18 Release date: 2000-03-30 Last modified: 2019-04-03 Method: X-RAY DIFFRACTION (1.9 Å) Cite: The Catalytic Pathway of Cytochrome P450Cam at Atomic Resolution Science, 287, 2000
4Y8W	Crystal Structure of Human Cytochrome P450 21A2 Progesterone Complex Descriptor: Cytochrome P450 21-hydroxylase, PROGESTERONE, PROTOPORPHYRIN IX CONTAINING FE, ... Authors: Pallan, P.S, Lei, L, Egli, M. Deposit date: 2015-02-16 Release date: 2015-04-15 Last modified: 2023-09-27 Method: X-RAY DIFFRACTION (2.64 Å) Cite: Human Cytochrome P450 21A2, the Major Steroid 21-Hydroxylase: STRUCTURE OF THE ENZYMEPROGESTERONE SUBSTRATE COMPLEX AND RATE-LIMITING C-H BOND CLEAVAGE. J.Biol.Chem., 290, 2015
1DZ6	ferrous p450cam from pseudomonas putida Descriptor: 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, CAMPHOR, CYTOCHROME P450-CAM, ... Authors: Schlichting, I, Berendzen, J, Chu, K, Stock, A.M, Maves, S.A, Benson, D.E, Sweet, R.M, Ringe, D, Petsko, G.A, Sligar, S.G. Deposit date: 2000-02-18 Release date: 2000-03-30 Last modified: 2019-04-03 Method: X-RAY DIFFRACTION (1.9 Å) Cite: The Catalytic Pathway of Cytochrome P450Cam at Atomic Resolution Science, 287, 2000
1EGY	CYTOCHROME P450ERYF WITH 9-AMINOPHENANTHRENE BOUND Descriptor: 9-AMINOPHENANTHRENE, CYTOCHROME P450ERYF, PROTOPORPHYRIN IX CONTAINING FE Authors: Cupp-Vickery, J.R, Anderson, R, Hatziris, Z. Deposit date: 2000-02-17 Release date: 2000-03-06 Last modified: 2024-02-07 Method: X-RAY DIFFRACTION (2.35 Å) Cite: Crystal structures of ligand complexes of P450eryF exhibiting homotropic cooperativity. Proc.Natl.Acad.Sci.USA, 97, 2000
1EHG	CRYSTAL STRUCTURES OF CYTOCHROME P450NOR AND ITS MUTANTS (SER286 VAL, THR) IN THE FERRIC RESTING STATE AT CRYOGENIC TEMPERATURE: A COMPARATIVE ANALYSIS WITH MONOOXYGENASE CYTOCHROME P450S Descriptor: CYTOCHROME P450NOR, PROTOPORPHYRIN IX CONTAINING FE Authors: Shimizu, H, Park, S. Deposit date: 2000-02-21 Release date: 2000-08-21 Last modified: 2024-02-07 Method: X-RAY DIFFRACTION (1.7 Å) Cite: Crystal structures of cytochrome P450nor and its mutants (Ser286-->Val, Thr) in the ferric resting state at cryogenic temperature: a comparative analysis with monooxygenase cytochrome P450s. J.Inorg.Biochem., 81, 2000
4YT3	CYP106A2 Descriptor: ACETATE ION, Cytochrome P450(MEG), PROTOPORPHYRIN IX CONTAINING FE Authors: janocha, S, carius, y, bernhardt, r, lancaster, c.r.d. Deposit date: 2015-03-17 Release date: 2016-02-24 Last modified: 2024-01-10 Method: X-RAY DIFFRACTION (1.8 Å) Cite: Crystal Structure of CYP106A2 in Substrate-Free and Substrate-Bound Form. Chembiochem, 17, 2016
4YZR	Bacillus subtilis 168 Bacillaene Polyketide Synthase (PKS) Cytochrome P450 PksS Descriptor: HISTIDINE, PROTOPORPHYRIN IX CONTAINING FE, Polyketide biosynthesis cytochrome P450 PksS Authors: Race, P.R, Zulkepli, A.Z, Anderson, R.J.L. Deposit date: 2015-03-25 Release date: 2016-04-13 Last modified: 2024-01-10 Method: X-RAY DIFFRACTION (1.35 Å) Cite: Bacillus subtilis 168 Bacillaene Polyketide Synthase (PKS) Cytochrome P450 PksS To Be Published
1E9X	Cytochrome P450 14 alpha-sterol demethylase (CYP51) from Mycobacterium tuberculosis in complex with 4-phenylimidazole Descriptor: 4-PHENYL-1H-IMIDAZOLE, CYTOCHROME P450 51-LIKE RV0764C, PROTOPORPHYRIN IX CONTAINING FE Authors: Podust, L.M, Poulos, T.L, Waterman, M.R. Deposit date: 2000-10-30 Release date: 2000-11-01 Last modified: 2017-07-05 Method: X-RAY DIFFRACTION (2.1 Å) Cite: Crystal Structure of Cytochrome P450 14Alpha -Sterol Demethylase (Cyp51) from Mycobacterium Tuberculosis in Complex with Azole Inhibitors Proc.Natl.Acad.Sci.USA, 98, 2001
1EUP	X-RAY CRYSTAL STRUCTURE OF CYTOCHROME P450ERYF WITH ANDROSTENDIONE BOUND Descriptor: 4-ANDROSTENE-3-17-DIONE, CYTOCHROME P450ERYF, PROTOPORPHYRIN IX CONTAINING FE Authors: Cupp-Vickery, J.R, Anderson, R, Hatziris, Z. Deposit date: 2000-04-17 Release date: 2000-04-28 Last modified: 2024-02-07 Method: X-RAY DIFFRACTION (2.1 Å) Cite: Crystal structures of ligand complexes of P450eryF exhibiting homotropic cooperativity. Proc.Natl.Acad.Sci.USA, 97, 2000
1EHF	CRYSTAL STRUCTURES OF CYTOCHROME P450NOR AND ITS MUTANTS (SER286 VAL, THR) IN THE FERRIC RESTING STATE AT CRYOGENIC TEMPERATURE: A COMPARATIVE ANALYSIS WITH MONOOXYGENASE CYTOCHROME P450S Descriptor: CYTOCHROME P450NOR, PROTOPORPHYRIN IX CONTAINING FE Authors: Shimizu, H, Park, S. Deposit date: 2000-02-21 Release date: 2000-08-21 Last modified: 2024-02-07 Method: X-RAY DIFFRACTION (1.7 Å) Cite: Crystal structures of cytochrome P450nor and its mutants (Ser286-->Val, Thr) in the ferric resting state at cryogenic temperature: a comparative analysis with monooxygenase cytochrome P450s. J.Inorg.Biochem., 81, 2000
4ZE3	Saccharomyces cerevisiae CYP51 (Lanosterol 14-alpha demethylase) Y140H mutant complexed with fluconazole Descriptor: 2-(2,4-DIFLUOROPHENYL)-1,3-DI(1H-1,2,4-TRIAZOL-1-YL)PROPAN-2-OL, Lanosterol 14-alpha demethylase, PROTOPORPHYRIN IX CONTAINING FE Authors: Sagatova, A, Keniya, M.V, Wilson, R, Monk, B.C, Tyndall, J.D.A. Deposit date: 2015-04-20 Release date: 2016-03-30 Last modified: 2023-09-27 Method: X-RAY DIFFRACTION (2.2 Å) Cite: Triazole resistance mediated by mutations of a conserved active site tyrosine in fungal lanosterol 14 alpha-demethylase. Sci Rep, 6, 2016

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