UniProt P14779
Bifunctional cytochrome P450/NADPH--P450 reductase (P14779)
Bifunctional cytochrome P450/NADPH--P450 reductase (UniProt P14779), EC 1.14.14.1, 1.6.2.4: 226 experimental structures and 1 predicted model on GenesisL1, 48 ligands bound, 103 pockets. Binding sites, druggability and experiment…
- UniProt
- P14779
- Protein
- Bifunctional cytochrome P450/NADPH--P450 reductase
- EC
- 1.14.14.1, 1.6.2.4
- Experimental structures
- 226
- Predicted models
- 1
- Ligands
- 48
- Pockets
- 103 · 15 records with a druggable one
Structures
227 records of P14779 in the MolNFT archive: 226 experimental, 1 predicted.
| Entry | Title | Method | Chains | Ligands | Pockets |
|---|---|---|---|---|---|
| 1BU7 | Cryogenic structure of cytochrome P450BM-3 heme domain | x-ray diffraction | A, B | — | — |
| 1BU7 | Cryogenic structure of cytochrome P450BM-3 heme domain | x-ray diffraction | A, B | — | — |
| 1BVY | Complex of the heme and FMN-binding domains of the cytochrome P450(BM-3) | x-ray diffraction | A, F, B | — | — |
| 1BVY | Complex of the heme and FMN-binding domains of the cytochrome P450(BM-3) | x-ray diffraction | A, F, B | — | — |
| 1FAG | Structure of cytochrome P450 | x-ray diffraction | A, B, C, D | — | — |
| 1FAG | Structure of cytochrome P450 | x-ray diffraction | A, B, C, D | — | — |
| 1FAH | Structure of cytochrome P450 | x-ray diffraction | A, B | — | — |
| 1FAH | Structure of cytochrome P450 | x-ray diffraction | A, B | — | — |
| 1JME | Crystal Structure of Phe393His Cytochrome P450 BM3 | x-ray diffraction | A, B | — | — |
| 1JME | Crystal structure of PHE393HIS cytochrome P450 BM3 | x-ray diffraction | A, B | — | — |
| 1JPZ | Crystal structure of a complex of the heme domain of P450BM-3 with N-Palmitoylglycine | x-ray diffraction | A, B | — | — |
| 1JPZ | Crystal structure of a complex of the heme domain of P450BM- 3 with N-palmitoylglycine | x-ray diffraction | A, B | — | — |
| 1P0V | F393A mutant heme domain of flavocytochrome P450 BM3 | x-ray diffraction | A, B | — | — |
| 1P0V | F393A mutant heme domain of flavocytochrome P450 BM3 | x-ray diffraction | A, B | — | — |
| 1P0W | F393W mutant heme domain of flavocytochrome P450 BM3 | x-ray diffraction | A, B | — | — |
| 1P0W | F393W mutant heme domain of flavocytochrome P450 BM3 | x-ray diffraction | A, B | — | — |
| 1P0X | F393Y mutant heme domain of flavocytochrome P450 BM3 | x-ray diffraction | A, B | — | — |
| 1P0X | F393Y mutant heme domain of flavocytochrome P450 BM3 | x-ray diffraction | A, B | — | — |
| 1SMI | A single mutation of P450 BM3 induces the conformational rearrangement seen upon substrate-binding… | x-ray diffraction | A, B | — | — |
| 1SMI | A single mutation of P450 BM3 induces the conformational rearrangement seen upon substrate-binding… | x-ray diffraction | A, B | — | — |
| 1SMJ | Structure of the A264E mutant of cytochrome P450 BM3 complexed with palmitoleate | x-ray diffraction | A, B, C, D | — | — |
| 1SMJ | Structure of the A264E mutant of cytochrome P450 BM3 complexed with palmitoleate | x-ray diffraction | A, B, C, D | — | — |
| 1YQO | T268A mutant heme domain of flavocytochrome P450 BM3 | x-ray diffraction | A, B | — | — |
| 1YQO | T268A mutant heme domain of flavocytochrome P450 BM3 | x-ray diffraction | A, B | — | — |
| 1YQP | T268N mutant cytochrome domain of flavocytochrome P450 BM3 | x-ray diffraction | A, B | — | — |
| 1YQP | T268N mutant cytochrome domain of flavocytochrome P450 BM3 | x-ray diffraction | A, B | — | — |
| 1ZO4 | Crystal Structure Of A328S Mutant Of The Heme Domain Of P450BM-3 | x-ray diffraction | A, B | — | — |
| 1ZO4 | Crystal structure of A328S mutant of the heme domain of P450BM-3 | x-ray diffraction | A, B | — | — |
| 1ZO9 | Crystal Structure Of The Wild Type Heme Domain Of P450BM-3 with N-palmitoylmethionine | x-ray diffraction | A, B | — | — |
| 1ZO9 | Crystal structure of the wild type heme domain of P450BM-3 with N- palmitoylmethionine | x-ray diffraction | A, B | — | — |
| 1ZOA | Crystal Structure Of A328V Mutant Of The Heme Domain Of P450Bm-3 With N-Palmitoylglycine | x-ray diffraction | A, B | — | — |
| 1ZOA | Crystal structure of A328V mutant of the heme domain of P450BM-3 with N-palmitoylglycine | x-ray diffraction | A, B | — | — |
| 2BMH | Modeling protein-substrate interactions in the heme domain of cytochrome P450BM-3 | x-ray diffraction | A, B | — | — |
| 2BMH | Modeling protein-substrate interactions in the heme domain of cytochrome P450BM-3 | x-ray diffraction | A, B | — | — |
| 2HPD | Crystal structure of hemoprotein domain of P450BM-3, a prototype for microsomal P450'S | x-ray diffraction | A, B | — | — |
| 2HPD | Crystal structure of hemoprotein domain of P450BM-3, a prototype for microsomal P450'S | x-ray diffraction | A, B | — | — |
| 2IJ2 | Atomic structure of the heme domain of flavocytochrome P450-BM3 | x-ray diffraction | A, B | — | — |
| 2IJ2 | Atomic structure of the heme domain of flavocytochrome P450- BM3 | x-ray diffraction | A, B | — | — |
| 2IJ3 | Structure of the A264H mutant of cytochrome P450 BM3 | x-ray diffraction | A, B | — | — |
| 2IJ3 | Structure of the A264H mutant of cytochrome P450 BM3 | x-ray diffraction | A, B | — | — |
| 2IJ4 | Structure of the A264K mutant of cytochrome P450 BM3 | x-ray diffraction | A, B | — | — |
| 2IJ4 | Structure of the A264K mutant of cytochrome P450 BM3 | x-ray diffraction | A, B | — | — |
| 2J1M | P450 BM3 Heme domain in complex with DMSO | x-ray diffraction | A, B | — | — |
| 2J1M | P450 BM3 heme domain in complex with dmso | x-ray diffraction | A, B | — | — |
| 2J4S | P450 BM3 heme domain in complex with DMSO | x-ray diffraction | A, B | — | — |
| 2J4S | P450 BM3 heme domain in complex with dmso | x-ray diffraction | A, B | — | — |
| 2NNB | The Q403K mutant heme domain of flavocytochrome P450 BM3 | x-ray diffraction | A, B | — | — |
| 2NNB | The Q403K mutant heme domain of flavocytochrome P450 BM3 | x-ray diffraction | A, B | — | — |
| 2UWH | Cytochrome P450 BM3 mutant in complex with palmitic acid | x-ray diffraction | A, B, C, D, E, F | — | — |
| 2UWH | Cytochrome P450 BM3 mutant in complex with palmitic acid | x-ray diffraction | A, B, C, D, E, F | — | — |
| 2X7Y | P450 BM3 F87A in complex with DMSO | x-ray diffraction | A, B | — | — |
| 2X7Y | P450 BM3 F87A in complex with dmso | x-ray diffraction | A, B | — | — |
| 2X80 | P450 BM3 F87A in complex with DMSO | x-ray diffraction | A, B | — | — |
| 2X80 | P450 BM3 F87A in complex with dmso | x-ray diffraction | A, B | — | — |
| 3BEN | Structure of N-(12-imidazolyl-dodecanoyl)-L-leucine inhibitor bound to the heme domain of… | x-ray diffraction | A, B | — | — |
| 3BEN | Structure of N-(12-imidazolyl-dodecanoyl)-L-leucine inhibitor bound to the heme domain of… | x-ray diffraction | A, B | — | — |
| 3CBD | Directed Evolution of cytochrome P450 BM3, to octane monoxygenase 139-3 | x-ray diffraction | A, B | — | — |
| 3CBD | Directed evolution of cytochrome P450 BM3, to octane monoxygenase 139- 3 | x-ray diffraction | A, B | — | — |
| 3DGI | Crystal structure of F87A/T268A mutant of CYP BM3 | x-ray diffraction | A, B | — | — |
| 3DGI | Crystal structure of F87A/T268A mutant of cyp BM3 | x-ray diffraction | A, B | — | — |
167 records more on the page itself.
Ligands
- HEM · Protoporphyrin IX containing Fe · in 49 records
- HOA · Hydroxyamine · in 6 records
- IRV · (2~{S})-2-(5-imidazol-1-ylpentanoylamino)-3-phenyl-propanoic acid · in 5 records
- D0L · (2S)-2-[[(2S)-1-heptylpyrrolidin-2-yl]carbonylamino]-3-phenyl-propanoic acid · in 4 records
- PO4 · Phosphate ion · in 4 records
- ZP6 · (2S)-3-phenyl-2-[[(2S)-1-phenylmethoxycarbonylpyrrolidin-2-yl]carbonylamino]propanoic acid · in 4 records
- GKX · (2~{S})-2-(5-cyclohexylpentanoylamino)-3-phenyl-propanoic acid · in 3 records
- 140 · N-palmitoylglycine · in 2 records
- 8PD · (2~{S})-2-(hexadecanoylamino)-4-oxidanyl-butanoic acid · in 2 records
- CMO · Carbon monoxide · in 2 records
- COH · Protoporphyrin IX containing co · in 2 records
- FDE · Fe(iii) deuteroporphyrin IX · in 2 records
- G56 · (2S)-3-phenyl-2-[2-[4-(trifluoromethyloxy) phenoxy]ethanoylamino]propanoic acid · in 2 records
- MG · Magnesium ion · in 2 records
- MI9 · Oxomolybdenum Mesoporphyrin IX · in 2 records
- MNH · Manganese protoporphyrin IX · in 2 records
- NEH · Ethanamine · in 2 records
- OPF · (2S)-2-[[(2S)-1-heptanoylpyrrolidin-2-yl]carbonylamino]-3-phenyl-propanoic acid · in 2 records
- RU8 · bis(2,2'-bipyridine-kappa~2~N~1~,N~1'~)[2-iodo-N-(1,10-phenanthrolin-5-yl-kappa~2~N~1~,N~10~)acetamide]ruthenium(2+) · in 2 records
- RUR · [3,3'-(7,12-diethyl-3,8,13,17-tetramethylporphyrin-2, 18-diyl-kappa~4~n~21~,n~22~,n~23~,n~24~) dipropanoato(2-)]ruthenium · in 2 records
- STQ · (1~{S})-1,2,3,4-tetrahydronaphthalen-1-amine · in 2 records
- TES · Testosterone · in 2 records
- TPF · 2-(2,4-difluorophenyl)-1,3-di(1h-1,2,4-triazol-1-yl)propan-2-ol · in 2 records
- VOR · Voriconazole · in 2 records
- YIC · (2S)-2-[[(2S)-1-(3-cyclopentylpropanoyl)piperidin-2-yl]carbonylamino]-3-phenyl-propanoic acid · in 2 records
- 0PY · Pyridine · in 1 record
- 1Y5 · (1R)-1,2,3,4-tetrahydronaphthalen-1-amine · in 1 record
- 3CN · 3-aminopropane · in 1 record
- 4MN · 4-methylaniline · in 1 record
- 87X · 5-cyclohexylpentanoic acid · in 1 record
Experiment against prediction
- 7CP8 chain A against the predicted model P14779: TM-score 0.99, RMSD 0.74 Å
- 6JO1 chain B against the predicted model P14779: TM-score 0.99, RMSD 0.74 Å
- 6K58 chain B against the predicted model P14779: TM-score 0.99, RMSD 0.75 Å
- 7CX8 chain B against the predicted model P14779: TM-score 0.99, RMSD 0.75 Å
- 4DUC chain B against the predicted model P14779: TM-score 0.99, RMSD 0.75 Å
- 4DUC chain B against the predicted model P14779: TM-score 0.99, RMSD 0.75 Å
- 5JTD chain A against the predicted model P14779: TM-score 0.99, RMSD 0.76 Å
- 5JTD chain A against the predicted model P14779: TM-score 0.99, RMSD 0.76 Å
- 3HF2 chain A against the predicted model P14779: TM-score 0.99, RMSD 0.74 Å
- 3HF2 chain A against the predicted model P14779: TM-score 0.99, RMSD 0.74 Å
Elsewhere
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