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ID of heme Axial ligands on heme Function & structure
1m70-B-200
sad. +0.05
ruf. -0.45
dom. -0.01
bre. -0.07
HIS chainID: B,
resSeq: 123,
molecule: Cytochrome c4
electron transporter
oligomeric count: 1
pocket vol.: 346.0 Å3
d(Fe-oop): 0.003 Å
MET chainID: B, resSeq: 167,

molecule: Cytochrome c4

2mbw-A-154
sad. +0.05
ruf. -0.01
dom. -0.24
bre. -0.13
HIS chainID: A,
resSeq: 93,
molecule: MYOGLOBIN
oxygen carrier
oligomeric count: 1
pocket vol.: 540.0 Å3
d(Fe-oop): 0.105 Å
HOH chainID: A, resSeq: 155,

molecule: water

2wx2-A-1450
sad. +0.05
ruf. -0.65
dom. -0.08
bre. -0.13
CYS chainID: A,
resSeq: 422,
molecule: LANOSTEROL 14-ALPHA-DEMETHYLASE
oxidoreductase
oligomeric count: 1
pocket vol.: 437.0 Å3
d(Fe-oop): 0.041 Å
TPF chainID: A, resSeq: 1460,

molecule: 2-(2,4-DIFLUOROPHENYL)-1,3-DI(1H-1,2,4-TRIAZOL-1-YL)PROPAN-2-OL

3mzs-A-500
sad. +0.05
ruf. -0.35
dom. +0.30
bre. +0.13
CYS chainID: A,
resSeq: 423,
molecule: Cholesterol side-chain cleavage enzyme
oxidoreductase
oligomeric count: 1
pocket vol.: 466.0 Å3
d(Fe-oop): 0.123 Å
HC9 chainID: A, resSeq: 501,

molecule: (3alpha,8alpha,22R)-cholest-5-ene-3,22-diol

4u8u-o-201
sad. +0.05
ruf. +0.32
dom. -0.06
bre. -0.35
HIS chainID: o,
resSeq: 100,
molecule: Globin c Chain
oxygen carrier
oligomeric count: 180
pocket vol.: 495.0 Å3
d(Fe-oop): 0.094 Å
CYN chainID: o, resSeq: 202,

molecule: CYANIDE ION

6dyc-A-202
sad. +0.05
ruf. +0.04
dom. -0.07
bre. -0.15
MET chainID: A,
resSeq: 7,
molecule: Soluble cytochrome b562
electron transporter
oligomeric count: 1
pocket vol.: 455.0 Å3
d(Fe-oop): 0.002 Å
HIS chainID: A, resSeq: 102,

molecule: Soluble cytochrome b562

1bzp-A-154
sad. +0.05
ruf. +0.04
dom. -0.31
bre. -0.24
HIS chainID: A,
resSeq: 93,
molecule: PROTEIN (MYOGLOBIN)
oxygen carrier
oligomeric count: 1
pocket vol.: 541.0 Å3
d(Fe-oop): 0.290 Å
Not assigned.
1lh6-A-154
sad. +0.05
ruf. -0.72
dom. -0.15
bre. -1.07
HIS chainID: A,
resSeq: 97,
molecule: LEGHEMOGLOBIN A (NICOTINATE MET)
oxygen carrier
oligomeric count: 1
pocket vol.: 515.0 Å3
d(Fe-oop): 0.155 Å
NIO chainID: A, resSeq: 155,

molecule: NICOTINIC ACID

2x2n-C-1478
sad. +0.05
ruf. -0.83
dom. -0.16
bre. +0.09
CYS chainID: C,
resSeq: 422,
molecule: LANOSTEROL 14-ALPHA-DEMETHYLASE
oxidoreductase
oligomeric count: 2
pocket vol.: 400.0 Å3
d(Fe-oop): 0.107 Å
X2N chainID: C, resSeq: 1479,

molecule: POSACONAZOLE

2b7h-B-200
sad. +0.05
ruf. -0.42
dom. -0.28
bre. -0.15
HIS chainID: B,
resSeq: 92,
molecule: hemoglobin beta chain
oxygen carrier
oligomeric count: 4
pocket vol.: 478.0 Å3
d(Fe-oop): 0.013 Å
HOH chainID: B, resSeq: 201,

molecule: water

5irq-D-602
sad. +0.05
ruf. +0.08
dom. -0.04
bre. -0.23
CYS chainID: D,
resSeq: 442,
molecule: Steroid 17-alpha-hydroxylase/17,20 lyase
oxidoreductase
oligomeric count: 1
pocket vol.: 428.0 Å3
d(Fe-oop): 0.135 Å
7D6 chainID: D, resSeq: 601,

molecule: (S)-orteronel

6m7x-A-602
sad. +0.05
ruf. +0.03
dom. +0.15
bre. -0.20
CYS chainID: A,
resSeq: 450,
molecule: Cytochrome P450 11B1, mitochondrial
oxidoreductase
oligomeric count: 1
pocket vol.: 426.0 Å3
d(Fe-oop): 0.053 Å
JD7 chainID: A, resSeq: 601,

molecule: 4-[(5S)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-5-yl]benzonitrile

1z8u-B-201
sad. +0.05
ruf. -0.06
dom. -0.01
bre. -0.24
HIS chainID: B,
resSeq: 58,
molecule: Hemoglobin alpha chain
oxygen carrier
oligomeric count: 2
pocket vol.: 451.0 Å3
d(Fe-oop): 0.009 Å
HIS chainID: B, resSeq: 87,

molecule: Hemoglobin alpha chain

2bc5-C-150
sad. +0.05
ruf. +0.04
dom. -0.22
bre. -0.19
MET chainID: C,
resSeq: 7,
molecule: Soluble cytochrome b562
electron transporter
oligomeric count: 1
pocket vol.: 446.0 Å3
d(Fe-oop): 0.126 Å
HIS chainID: C, resSeq: 102,

molecule: Soluble cytochrome b562

3i8r-C-903
sad. +0.05
ruf. +0.59
dom. +0.10
bre. -0.03
HIS chainID: C,
resSeq: 620,
molecule: Heme oxygenase
oxidoreductase
oligomeric count: 1
pocket vol.: 563.0 Å3
d(Fe-oop): 0.081 Å
DTV chainID: C, resSeq: 2003,

molecule: (2S,3S)-1,4-DIMERCAPTOBUTANE-2,3-DIOL

3ua5-B-500
sad. +0.05
ruf. +0.16
dom. -0.00
bre. +0.82
CYS chainID: B,
resSeq: 436,
molecule: Cytochrome P450 2B6
oxidoreductase
oligomeric count: 1
pocket vol.: 385.0 Å3
d(Fe-oop): 0.116 Å
06X chainID: B, resSeq: 501,

molecule: Amlodipine

4l3x-A-608
sad. +0.05
ruf. -0.47
dom. -0.13
bre. -0.52
HIS chainID: A,
resSeq: 18,
molecule: Eight-heme nitrite reductase
oxidoreductase
oligomeric count: 6
pocket vol.: 430.0 Å3
d(Fe-oop): 0.013 Å
HIS chainID: A, resSeq: 44,

molecule: Eight-heme nitrite reductase

6qc2-c2-501
sad. +0.05
ruf. -0.94
dom. -0.32
bre. +0.16
HIS chainID: c2,
resSeq: 41,
molecule: Cytochrome c1
electron transporter
oligomeric count: 65
pocket vol.: 482.0 Å3
d(Fe-oop): 0.114 Å
MET chainID: c2, resSeq: 159,

molecule: Cytochrome c1

3iq6-G-150
sad. +0.05
ruf. +0.03
dom. +0.01
bre. -0.09
MET chainID: G,
resSeq: 7,
molecule: Soluble cytochrome b562
electron transporter
oligomeric count: 4
pocket vol.: 465.0 Å3
d(Fe-oop): 0.017 Å
HIS chainID: G, resSeq: 102,

molecule: Soluble cytochrome b562

4c9l-A-1418
sad. +0.05
ruf. -0.41
dom. +0.02
bre. -0.14
CYS chainID: A,
resSeq: 365,
molecule: CYTOCHROME P450
oxidoreductase
oligomeric count: 1
pocket vol.: 429.0 Å3
d(Fe-oop): 0.062 Å
CYN chainID: A, resSeq: 1420,

molecule: CYANIDE ION