Browser
| ID of heme | Axial ligands on heme | Function & structure | ||
|---|---|---|---|---|
| 6b9b-B-801 |
sad. -0.89 ruf. +0.08 dom. +0.22 bre. +0.01 |
TOX | chainID: B, resSeq: 111, molecule: Catalase-peroxidase |
oxidoreductase oligomeric count: 2 pocket vol.: 384.0 Å3 d(Fe-oop): 0.082 Å |
| HIS | chainID: B, resSeq: 279, molecule: Catalase-peroxidase |
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| 6bb5-A-201 |
sad. +0.05 ruf. -0.43 dom. -0.34 bre. -0.19 |
HIS | chainID: A, resSeq: 87, molecule: Hemoglobin subunit alpha |
oxygen carrier oligomeric count: 4 pocket vol.: 544.0 Å3 d(Fe-oop): 0.036 Å |
| OXY | chainID: A, resSeq: 202, molecule: OXYGEN MOLECULE |
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| 6bb5-B-201 |
sad. +0.31 ruf. -0.32 dom. -0.20 bre. -0.23 |
HIS | chainID: B, resSeq: 92, molecule: Hemoglobin subunit beta |
oxygen carrier oligomeric count: 4 pocket vol.: 562.0 Å3 d(Fe-oop): 0.030 Å |
| OXY | chainID: B, resSeq: 202, molecule: OXYGEN MOLECULE |
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| 6bcz-A-601 |
sad. -0.17 ruf. +0.29 dom. +0.08 bre. -0.14 |
CYS | chainID: A, resSeq: 442, molecule: Cytochrome P450 3A4 |
oxidoreductase oligomeric count: 4 pocket vol.: 424.0 Å3 d(Fe-oop): 0.112 Å |
| D7Y | chainID: A, resSeq: 602, molecule: tert-butyl (2-{[(2R)-3-oxo-2-[(propan-2-yl)amino]-3-{[(pyridin-3-yl)methyl]amino}propyl]sulfanyl}ethyl)carbamate |
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| 6bd5-A-601 |
sad. -0.17 ruf. +0.37 dom. +0.07 bre. -0.06 |
CYS | chainID: A, resSeq: 442, molecule: Cytochrome P450 3A4 |
oxidoreductase oligomeric count: 4 pocket vol.: 439.0 Å3 d(Fe-oop): 0.001 Å |
| D7M | chainID: A, resSeq: 602, molecule: tert-butyl (2-{[(2R)-2-(cyclopentylamino)-3-oxo-3-{[(pyridin-3-yl)methyl]amino}propyl]sulfanyl}ethyl)carbamate |
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| 6bd6-A-601 |
sad. -0.25 ruf. +0.32 dom. -0.01 bre. -0.11 |
CYS | chainID: A, resSeq: 442, molecule: Cytochrome P450 3A4 |
oxidoreductase oligomeric count: 4 pocket vol.: 405.0 Å3 d(Fe-oop): 0.048 Å |
| 80K | chainID: A, resSeq: 602, molecule: tert-butyl (2-{[(2S)-3-oxo-2-(phenylamino)-3-{[(pyridin-3-yl)methyl]amino}propyl]sulfanyl}ethyl)carbamate |
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| 6bd7-A-601 |
sad. -0.20 ruf. +0.20 dom. +0.08 bre. -0.14 |
CYS | chainID: A, resSeq: 442, molecule: Cytochrome P450 3A4 |
oxidoreductase oligomeric count: 2 pocket vol.: 446.0 Å3 d(Fe-oop): 0.046 Å |
| D7J | chainID: A, resSeq: 602, molecule: tert-butyl [(2S)-1-{[(2R)-3-oxo-2-[(propan-2-yl)amino]-3-{[(pyridin-3-yl)methyl]amino}propyl]sulfanyl}-3-phenylpropan-2-yl]carbamate |
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| 6bd8-A-601 |
sad. -0.19 ruf. +0.12 dom. -0.05 bre. -0.16 |
CYS | chainID: A, resSeq: 442, molecule: Cytochrome P450 3A4 |
oxidoreductase oligomeric count: 2 pocket vol.: 430.0 Å3 d(Fe-oop): 0.010 Å |
| D81 | chainID: A, resSeq: 602, molecule: S-{(2S)-2-[(1-tert-butoxyethenyl)amino]-3-phenylpropyl}-N~2~-cyclopentyl-N-[(pyridin-3-yl)methyl]-L-cysteinamide |
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| 6bdd-A-201 |
sad. +0.03 ruf. +0.37 dom. -0.79 bre. +0.04 |
HIS | chainID: A, resSeq: 104, molecule: 2,4-dihydroxyhept-2-ene-1,7-dioic acid aldolase |
unclassified oligomeric count: 1 pocket vol.: 417.0 Å3 d(Fe-oop): 0.190 Å |
| Not assigned. | ||||
| 6bde-A-201 |
sad. -0.09 ruf. -0.15 dom. -1.13 bre. -0.54 |
HIS | chainID: A, resSeq: 104, molecule: 2,4-dihydroxyhept-2-ene-1,7-dioic acid aldolase |
unclassified oligomeric count: 1 pocket vol.: 433.0 Å3 d(Fe-oop): 0.537 Å |
| Not assigned. | ||||
| 6bdh-A-601 |
sad. -0.20 ruf. +0.11 dom. -0.03 bre. -0.20 |
CYS | chainID: A, resSeq: 442, molecule: Cytochrome P450 3A4 |
oxidoreductase oligomeric count: 2 pocket vol.: 415.0 Å3 d(Fe-oop): 0.053 Å |
| DEV | chainID: A, resSeq: 602, molecule: tert-butyl [(2S)-1-{[(2S)-3-oxo-2-(phenylamino)-3-{[(pyridin-3-yl)methyl]amino}propyl]sulfanyl}-3-phenylpropan-2-yl]carbamate |
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| 6bdi-A-601 |
sad. -0.16 ruf. +0.16 dom. +0.20 bre. -0.13 |
CYS | chainID: A, resSeq: 442, molecule: Cytochrome P450 3A4 |
oxidoreductase oligomeric count: 2 pocket vol.: 424.0 Å3 d(Fe-oop): 0.013 Å |
| DEJ | chainID: A, resSeq: 602, molecule: tert-butyl [(2S)-1-(1H-indol-3-yl)-3-{[(2R)-3-oxo-2-[(propan-2-yl)amino]-3-{[(pyridin-3-yl)methyl]amino}propyl]sulfanyl}propan-2-yl]carbamate |
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| 6bdk-A-601 |
sad. -0.16 ruf. +0.06 dom. -0.01 bre. -0.04 |
CYS | chainID: A, resSeq: 442, molecule: Cytochrome P450 3A4 |
oxidoreductase oligomeric count: 4 pocket vol.: 429.0 Å3 d(Fe-oop): 0.019 Å |
| DJ1 | chainID: A, resSeq: 602, molecule: tert-butyl [(2S)-1-{[(2R)-2-(cyclopentylamino)-3-oxo-3-{[(pyridin-3-yl)methyl]amino}propyl]sulfanyl}-3-(1H-indol-3-yl)propan-2-yl]carbamate |
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| 6bdm-A-601 |
sad. -0.26 ruf. +0.19 dom. +0.13 bre. +0.03 |
CYS | chainID: A, resSeq: 442, molecule: Cytochrome P450 3A4 |
oxidoreductase oligomeric count: 2 pocket vol.: 419.0 Å3 d(Fe-oop): 0.096 Å |
| Y83 | chainID: A, resSeq: 602, molecule: tert-butyl [(2S)-1-(1H-indol-3-yl)-3-{[(2S)-3-oxo-2-(phenylamino)-3-{[(pyridin-3-yl)methyl]amino}propyl]sulfanyl}propan-2-yl]carbamate |
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| 6bl3-A-705 |
sad. -0.58 ruf. +0.23 dom. -0.43 bre. -0.13 |
HIS | chainID: A, resSeq: 388, molecule: Prostaglandin G/H synthase 2 |
oxidoreductase oligomeric count: 2 pocket vol.: 556.0 Å3 d(Fe-oop): 0.132 Å |
| HOH | chainID: A, resSeq: 941, molecule: water |
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| 6bl3-B-705 |
sad. -0.59 ruf. +0.37 dom. -0.40 bre. -0.14 |
HIS | chainID: B, resSeq: 388, molecule: Prostaglandin G/H synthase 2 |
oxidoreductase oligomeric count: 2 pocket vol.: 547.0 Å3 d(Fe-oop): 0.051 Å |
| Not assigned. | ||||
| 6bl3-C-705 |
sad. -0.56 ruf. +0.29 dom. -0.35 bre. -0.14 |
HIS | chainID: C, resSeq: 388, molecule: Prostaglandin G/H synthase 2 |
oxidoreductase oligomeric count: 2 pocket vol.: 529.0 Å3 d(Fe-oop): 0.080 Å |
| HOH | chainID: C, resSeq: 877, molecule: water |
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| 6bl3-D-705 |
sad. -0.57 ruf. +0.25 dom. -0.41 bre. -0.15 |
HIS | chainID: D, resSeq: 388, molecule: Prostaglandin G/H synthase 2 |
oxidoreductase oligomeric count: 2 pocket vol.: 520.0 Å3 d(Fe-oop): 0.124 Å |
| HOH | chainID: D, resSeq: 858, molecule: water |
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| 6bl4-A-701 |
sad. -0.60 ruf. +0.52 dom. -0.39 bre. -0.12 |
HIS | chainID: A, resSeq: 388, molecule: Prostaglandin G/H synthase 2 |
oxidoreductase oligomeric count: 2 pocket vol.: 540.0 Å3 d(Fe-oop): 0.077 Å |
| Not assigned. | ||||
| 6bl4-B-701 |
sad. -0.57 ruf. +0.42 dom. -0.16 bre. +0.41 |
HIS | chainID: B, resSeq: 388, molecule: Prostaglandin G/H synthase 2 |
oxidoreductase oligomeric count: 2 pocket vol.: 534.0 Å3 d(Fe-oop): 0.166 Å |
| Not assigned. | ||||