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| ID of heme | Axial ligands on heme | Function & structure | ||
|---|---|---|---|---|
| 8fda-B-600 |
sad. -0.28 ruf. +0.19 dom. -0.15 bre. -0.04 |
CYS | chainID: B, resSeq: 442, molecule: Steroid 17-alpha-hydroxylase/17,20 lyase |
oxidoreductase oligomeric count: 1 pocket vol.: 417.0 Å3 d(Fe-oop): 0.041 Å |
| XPK | chainID: B, resSeq: 601, molecule: [(1~{R})-1-[(3~{S},5~{S},8~{R},9~{S},10~{S},13~{S},17~{R})-3-methanoyloxy-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,13,14,15,16,17-hexadecahydrocyclopenta[a]phenanthren-17-yl]ethyl]-methylidyne-azanium |
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| 8fda-C-600 |
sad. -0.04 ruf. +0.04 dom. -0.21 bre. -0.18 |
CYS | chainID: C, resSeq: 442, molecule: Steroid 17-alpha-hydroxylase/17,20 lyase |
oxidoreductase oligomeric count: 1 pocket vol.: 442.0 Å3 d(Fe-oop): 0.175 Å |
| XPK | chainID: C, resSeq: 601, molecule: [(1~{R})-1-[(3~{S},5~{S},8~{R},9~{S},10~{S},13~{S},17~{R})-3-methanoyloxy-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,13,14,15,16,17-hexadecahydrocyclopenta[a]phenanthren-17-yl]ethyl]-methylidyne-azanium |
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| 8fda-D-600 |
sad. -0.09 ruf. +0.27 dom. -0.21 bre. -0.11 |
CYS | chainID: D, resSeq: 442, molecule: Steroid 17-alpha-hydroxylase/17,20 lyase |
oxidoreductase oligomeric count: 1 pocket vol.: 446.0 Å3 d(Fe-oop): 0.064 Å |
| XPK | chainID: D, resSeq: 601, molecule: [(1~{R})-1-[(3~{S},5~{S},8~{R},9~{S},10~{S},13~{S},17~{R})-3-methanoyloxy-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,13,14,15,16,17-hexadecahydrocyclopenta[a]phenanthren-17-yl]ethyl]-methylidyne-azanium |
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| 8fdj-A-201 |
sad. +0.10 ruf. -0.40 dom. -0.17 bre. +0.08 |
HIS | chainID: A, resSeq: 93, molecule: Myoglobin |
oxygen carrier oligomeric count: 1 pocket vol.: 525.0 Å3 d(Fe-oop): 0.010 Å |
| NBE | chainID: A, resSeq: 202, molecule: NITROSOBENZENE |
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| 8fdk-A-201 |
sad. +0.06 ruf. -0.44 dom. -0.32 bre. -0.15 |
HIS | chainID: A, resSeq: 87, molecule: Hemoglobin subunit alpha |
oxygen carrier oligomeric count: 4 pocket vol.: 532.0 Å3 d(Fe-oop): 0.002 Å |
| HOH | chainID: A, resSeq: 327, molecule: water |
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| 8fdk-B-201 |
sad. -0.24 ruf. -0.44 dom. +0.19 bre. -0.25 |
HIS | chainID: B, resSeq: 63, molecule: Hemoglobin subunit beta |
oxygen carrier oligomeric count: 4 pocket vol.: 628.0 Å3 d(Fe-oop): 0.009 Å |
| HIS | chainID: B, resSeq: 92, molecule: Hemoglobin subunit beta |
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| 8fdk-C-201 |
sad. +0.03 ruf. -0.45 dom. -0.34 bre. -0.19 |
HIS | chainID: C, resSeq: 87, molecule: Hemoglobin subunit alpha |
oxygen carrier oligomeric count: 4 pocket vol.: 510.0 Å3 d(Fe-oop): 0.009 Å |
| HOH | chainID: C, resSeq: 323, molecule: water |
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| 8fdk-D-201 |
sad. -0.08 ruf. -0.51 dom. +0.11 bre. -0.24 |
HIS | chainID: D, resSeq: 63, molecule: Hemoglobin subunit beta |
oxygen carrier oligomeric count: 4 pocket vol.: 656.0 Å3 d(Fe-oop): 0.030 Å |
| HIS | chainID: D, resSeq: 92, molecule: Hemoglobin subunit beta |
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| 8fdl-A-201 |
sad. +0.07 ruf. -0.35 dom. -0.67 bre. -0.20 |
HIS | chainID: A, resSeq: 87, molecule: Hemoglobin subunit alpha |
oxygen carrier oligomeric count: 4 pocket vol.: 539.0 Å3 d(Fe-oop): 0.420 Å |
| Not assigned. | ||||
| 8fdl-B-201 |
sad. +0.46 ruf. +0.28 dom. -0.53 bre. -0.20 |
HIS | chainID: B, resSeq: 92, molecule: Hemoglobin subunit beta |
oxygen carrier oligomeric count: 4 pocket vol.: 598.0 Å3 d(Fe-oop): 0.323 Å |
| Not assigned. | ||||
| 8fdl-C-201 |
sad. +0.01 ruf. -0.31 dom. -0.61 bre. -0.14 |
HIS | chainID: C, resSeq: 87, molecule: Hemoglobin subunit alpha |
oxygen carrier oligomeric count: 4 pocket vol.: 579.0 Å3 d(Fe-oop): 0.446 Å |
| Not assigned. | ||||
| 8fdl-D-201 |
sad. +0.26 ruf. +0.10 dom. -0.50 bre. -0.22 |
HIS | chainID: D, resSeq: 92, molecule: Hemoglobin subunit beta |
oxygen carrier oligomeric count: 4 pocket vol.: 573.0 Å3 d(Fe-oop): 0.354 Å |
| Not assigned. | ||||
| 8fdm-A-201 |
sad. +0.01 ruf. -0.54 dom. -0.24 bre. -0.18 |
HIS | chainID: A, resSeq: 87, molecule: Hemoglobin subunit alpha |
oxygen carrier oligomeric count: 4 pocket vol.: 523.0 Å3 d(Fe-oop): 0.027 Å |
| HOH | chainID: A, resSeq: 312, molecule: water |
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| 8fdm-B-201 |
sad. +0.33 ruf. -0.27 dom. -0.21 bre. -0.24 |
HIS | chainID: B, resSeq: 92, molecule: Hemoglobin subunit beta |
oxygen carrier oligomeric count: 4 pocket vol.: 527.0 Å3 d(Fe-oop): 0.104 Å |
| NSM | chainID: B, resSeq: 202, molecule: NITROSOMETHANE |
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| 8fdm-C-201 |
sad. -0.02 ruf. -0.51 dom. -0.26 bre. -0.18 |
HIS | chainID: C, resSeq: 87, molecule: Hemoglobin subunit alpha |
oxygen carrier oligomeric count: 4 pocket vol.: 534.0 Å3 d(Fe-oop): 0.039 Å |
| HOH | chainID: C, resSeq: 325, molecule: water |
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| 8fdm-D-201 |
sad. +0.34 ruf. -0.23 dom. -0.22 bre. -0.22 |
HIS | chainID: D, resSeq: 92, molecule: Hemoglobin subunit beta |
oxygen carrier oligomeric count: 4 pocket vol.: 571.0 Å3 d(Fe-oop): 0.167 Å |
| NSM | chainID: D, resSeq: 202, molecule: NITROSOMETHANE |
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| 8fdn-A-302 |
sad. +0.05 ruf. -0.50 dom. -0.32 bre. -0.01 |
HIS | chainID: A, resSeq: 87, molecule: Hemoglobin subunit alpha |
oxygen carrier oligomeric count: 4 pocket vol.: 505.0 Å3 d(Fe-oop): 0.008 Å |
| HOH | chainID: A, resSeq: 406, molecule: water |
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| 8fdn-B-201 |
sad. -0.35 ruf. -0.74 dom. -0.02 bre. -0.26 |
HIS | chainID: B, resSeq: 63, molecule: Hemoglobin subunit beta |
oxygen carrier oligomeric count: 4 pocket vol.: 662.0 Å3 d(Fe-oop): 0.041 Å |
| HIS | chainID: B, resSeq: 92, molecule: Hemoglobin subunit beta |
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| 8fdn-C-201 |
sad. -0.04 ruf. -0.69 dom. -0.36 bre. +0.11 |
HIS | chainID: C, resSeq: 87, molecule: Hemoglobin subunit alpha |
oxygen carrier oligomeric count: 4 pocket vol.: 500.0 Å3 d(Fe-oop): 0.069 Å |
| HOH | chainID: C, resSeq: 310, molecule: water |
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| 8fdn-D-201 |
sad. -0.21 ruf. -0.70 dom. -0.04 bre. -0.31 |
HIS | chainID: D, resSeq: 63, molecule: Hemoglobin subunit beta |
oxygen carrier oligomeric count: 4 pocket vol.: 626.0 Å3 d(Fe-oop): 0.099 Å |
| HIS | chainID: D, resSeq: 92, molecule: Hemoglobin subunit beta |
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