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| ID of heme | Axial ligands on heme | Function & structure | ||
|---|---|---|---|---|
| 3t3r-A-500 |
sad. -0.09 ruf. -0.75 dom. +0.02 bre. -0.28 |
CYS | chainID: A, resSeq: 439, molecule: Cytochrome P450 2A6 |
oxidoreductase oligomeric count: 1 pocket vol.: 426.0 Å3 d(Fe-oop): 0.048 Å |
| 9PL | chainID: A, resSeq: 501, molecule: (3S,4R)-3-ethyl-4-[(1-methyl-1H-imidazol-5-yl)methyl]dihydrofuran-2(3H)-one |
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| 3t3r-B-500 |
sad. -0.21 ruf. -0.64 dom. +0.11 bre. -0.22 |
CYS | chainID: B, resSeq: 439, molecule: Cytochrome P450 2A6 |
oxidoreductase oligomeric count: 1 pocket vol.: 433.0 Å3 d(Fe-oop): 0.088 Å |
| 9PL | chainID: B, resSeq: 501, molecule: (3S,4R)-3-ethyl-4-[(1-methyl-1H-imidazol-5-yl)methyl]dihydrofuran-2(3H)-one |
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| 3t3r-C-500 |
sad. -0.14 ruf. -0.72 dom. +0.10 bre. -0.33 |
CYS | chainID: C, resSeq: 439, molecule: Cytochrome P450 2A6 |
oxidoreductase oligomeric count: 1 pocket vol.: 412.0 Å3 d(Fe-oop): 0.077 Å |
| 9PL | chainID: C, resSeq: 501, molecule: (3S,4R)-3-ethyl-4-[(1-methyl-1H-imidazol-5-yl)methyl]dihydrofuran-2(3H)-one |
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| 3t3r-D-500 |
sad. -0.34 ruf. -0.55 dom. +0.01 bre. -0.15 |
CYS | chainID: D, resSeq: 439, molecule: Cytochrome P450 2A6 |
oxidoreductase oligomeric count: 1 pocket vol.: 425.0 Å3 d(Fe-oop): 0.073 Å |
| 9PL | chainID: D, resSeq: 501, molecule: (3S,4R)-3-ethyl-4-[(1-methyl-1H-imidazol-5-yl)methyl]dihydrofuran-2(3H)-one |
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