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ID of heme Axial ligands on heme Function & structure
3d4x-C-143
sad. +0.03
ruf. -0.35
dom. -0.21
bre. -0.35
HIS chainID: C,
resSeq: 87,
molecule: Hemoglobin subunit alpha
oxygen carrier
oligomeric count: 4
pocket vol.: 537.0 Å3
d(Fe-oop): 0.003 Å
HOH chainID: C, resSeq: 142,

molecule: water

3d4x-D-148
sad. +0.03
ruf. -0.24
dom. -0.30
bre. -0.29
HIS chainID: D,
resSeq: 92,
molecule: Hemoglobin subunit beta-A/B
oxygen carrier
oligomeric count: 4
pocket vol.: 545.0 Å3
d(Fe-oop): 0.042 Å
HOH chainID: D, resSeq: 164,

molecule: water

3d7o-A-143
sad. +0.03
ruf. -0.55
dom. -0.34
bre. -0.24
HIS chainID: A,
resSeq: 87,
molecule: Hemoglobin subunit alpha
oxygen carrier
oligomeric count: 4
pocket vol.: 526.0 Å3
d(Fe-oop): 0.000 Å
NO2 chainID: A, resSeq: 142,

molecule: NITRITE ION

3d7o-B-148
sad. +0.35
ruf. -0.27
dom. -0.34
bre. -0.34
HIS chainID: B,
resSeq: 92,
molecule: Hemoglobin subunit beta
oxygen carrier
oligomeric count: 4
pocket vol.: 536.0 Å3
d(Fe-oop): 0.042 Å
NO2 chainID: B, resSeq: 147,

molecule: NITRITE ION

3dam-A-600
sad. -0.26
ruf. -0.03
dom. -0.07
bre. -0.10
CYS chainID: A,
resSeq: 426,
molecule: Cytochrome P450 74A2
lyase
oligomeric count: 1
pocket vol.: 435.0 Å3
d(Fe-oop): 0.033 Å
Not assigned.
3dan-A-600
sad. -0.27
ruf. -0.03
dom. -0.06
bre. -0.10
CYS chainID: A,
resSeq: 426,
molecule: Cytochrome P450 74A2
lyase
oligomeric count: 1
pocket vol.: 439.0 Å3
d(Fe-oop): 0.034 Å
Not assigned.
3dax-A-601
sad. -0.31
ruf. +0.44
dom. -0.11
bre. -0.12
CYS chainID: A,
resSeq: 444,
molecule: Cytochrome P450 7A1
oxidoreductase
oligomeric count: 2
pocket vol.: 514.0 Å3
d(Fe-oop): 0.162 Å
UNX chainID: A, resSeq: 1,

molecule: UNKNOWN ATOM OR ION

3dax-B-601
sad. -0.31
ruf. +0.39
dom. -0.12
bre. -0.11
CYS chainID: B,
resSeq: 444,
molecule: Cytochrome P450 7A1
oxidoreductase
oligomeric count: 2
pocket vol.: 494.0 Å3
d(Fe-oop): 0.167 Å
UNX chainID: B, resSeq: 2,

molecule: UNKNOWN ATOM OR ION

3dbg-A-500
sad. +0.04
ruf. -0.00
dom. -0.08
bre. -0.65
CYS chainID: A,
resSeq: 410,
molecule: Putative cytochrome P450
oxidoreductase
oligomeric count: 1
pocket vol.: 552.0 Å3
d(Fe-oop): 0.178 Å
Not assigned.
3dbg-B-500
sad. +0.02
ruf. -0.01
dom. -0.07
bre. -0.64
CYS chainID: B,
resSeq: 410,
molecule: Putative cytochrome P450
oxidoreductase
oligomeric count: 1
pocket vol.: 562.0 Å3
d(Fe-oop): 0.103 Å
Not assigned.
3dbm-A-600
sad. -0.26
ruf. -0.04
dom. -0.00
bre. -0.14
CYS chainID: A,
resSeq: 426,
molecule: Cytochrome P450 74A2
lyase
oligomeric count: 1
pocket vol.: 461.0 Å3
d(Fe-oop): 0.008 Å
Not assigned.
3ddr-C-200
sad. -0.04
ruf. -0.01
dom. +0.00
bre. -0.30
TYR chainID: C,
resSeq: 75,
molecule: Hemophore HasA
heme acquisition
oligomeric count: 2
pocket vol.: 589.0 Å3
d(Fe-oop): 0.007 Å
Not assigned.
3ddr-D-200
sad. -0.03
ruf. +0.02
dom. -0.01
bre. -0.29
TYR chainID: D,
resSeq: 75,
molecule: Hemophore HasA
heme acquisition
oligomeric count: 2
pocket vol.: 554.0 Å3
d(Fe-oop): 0.046 Å
Not assigned.
3de8-A-150
sad. -0.06
ruf. -0.10
dom. +0.05
bre. -0.18
MET chainID: A,
resSeq: 7,
molecule: Soluble cytochrome b562
electron transporter
oligomeric count: 2
pocket vol.: 464.0 Å3
d(Fe-oop): 0.046 Å
HIS chainID: A, resSeq: 102,

molecule: Soluble cytochrome b562

3de8-B-150
sad. +0.05
ruf. -0.01
dom. -0.08
bre. -0.17
MET chainID: B,
resSeq: 7,
molecule: Soluble cytochrome b562
electron transporter
oligomeric count: 2
pocket vol.: 426.0 Å3
d(Fe-oop): 0.004 Å
HIS chainID: B, resSeq: 102,

molecule: Soluble cytochrome b562

3de8-C-150
sad. +0.03
ruf. -0.05
dom. -0.09
bre. -0.24
MET chainID: C,
resSeq: 7,
molecule: Soluble cytochrome b562
electron transporter
oligomeric count: 2
pocket vol.: 465.0 Å3
d(Fe-oop): 0.038 Å
HIS chainID: C, resSeq: 102,

molecule: Soluble cytochrome b562

3de8-D-150
sad. -0.35
ruf. -0.63
dom. +0.05
bre. -0.27
MET chainID: D,
resSeq: 7,
molecule: Soluble cytochrome b562
electron transporter
oligomeric count: 2
pocket vol.: 430.0 Å3
d(Fe-oop): 0.066 Å
HIS chainID: D, resSeq: 102,

molecule: Soluble cytochrome b562

3de9-A-150
sad. -0.05
ruf. -0.05
dom. -0.11
bre. -0.30
MET chainID: A,
resSeq: 7,
molecule: Soluble cytochrome b562
electron transporter
oligomeric count: 3
pocket vol.: 438.0 Å3
d(Fe-oop): 0.075 Å
HIS chainID: A, resSeq: 102,

molecule: Soluble cytochrome b562

3dgi-A-501
sad. -0.28
ruf. -0.45
dom. +0.04
bre. -0.16
CYS chainID: A,
resSeq: 400,
molecule: Bifunctional P-450/NADPH-P450 reductase
oxidoreductase
oligomeric count: 1
pocket vol.: 465.0 Å3
d(Fe-oop): 0.201 Å
DMS chainID: A, resSeq: 503,

molecule: DIMETHYL SULFOXIDE

3dgi-B-501
sad. -0.31
ruf. -0.38
dom. -0.07
bre. -0.11
CYS chainID: B,
resSeq: 400,
molecule: Bifunctional P-450/NADPH-P450 reductase
oxidoreductase
oligomeric count: 1
pocket vol.: 455.0 Å3
d(Fe-oop): 0.187 Å
DMS chainID: B, resSeq: 504,

molecule: DIMETHYL SULFOXIDE