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ID of heme Axial ligands on heme Function & structure
3ag1-N-515
sad. -0.55
ruf. +0.41
dom. +0.18
bre. -0.19
HIS chainID: N,
resSeq: 61,
molecule: Cytochrome c oxidase subunit 1
oxidoreductase
oligomeric count: 13
pocket vol.: 636.0 Å3
d(Fe-oop): 0.011 Å
HIS chainID: N, resSeq: 378,

molecule: Cytochrome c oxidase subunit 1

3ag1-N-516
sad. -0.27
ruf. -0.02
dom. +0.43
bre. -0.06
HIS chainID: N,
resSeq: 376,
molecule: Cytochrome c oxidase subunit 1
oxidoreductase
oligomeric count: 13
pocket vol.: 736.0 Å3
d(Fe-oop): 0.163 Å
CMO chainID: N, resSeq: 520,

molecule: CARBON MONOXIDE

3ag2-A-601
sad. -0.52
ruf. +0.11
dom. +0.21
bre. -0.19
HIS chainID: A,
resSeq: 61,
molecule: Cytochrome c oxidase subunit 1
translocase
oligomeric count: 13
pocket vol.: 585.0 Å3
d(Fe-oop): 0.049 Å
HIS chainID: A, resSeq: 378,

molecule: Cytochrome c oxidase subunit 1

3ag2-A-602
sad. -0.42
ruf. -0.01
dom. +0.66
bre. -0.13
HIS chainID: A,
resSeq: 376,
molecule: Cytochrome c oxidase subunit 1
translocase
oligomeric count: 13
pocket vol.: 679.0 Å3
d(Fe-oop): 0.301 Å
CMO chainID: A, resSeq: 606,

molecule: CARBON MONOXIDE

3ag2-N-601
sad. -0.54
ruf. +0.18
dom. +0.16
bre. -0.12
HIS chainID: N,
resSeq: 61,
molecule: Cytochrome c oxidase subunit 1
translocase
oligomeric count: 13
pocket vol.: 615.0 Å3
d(Fe-oop): 0.030 Å
HIS chainID: N, resSeq: 378,

molecule: Cytochrome c oxidase subunit 1

3ag2-N-602
sad. -0.40
ruf. -0.07
dom. +0.68
bre. -0.03
HIS chainID: N,
resSeq: 376,
molecule: Cytochrome c oxidase subunit 1
translocase
oligomeric count: 13
pocket vol.: 686.0 Å3
d(Fe-oop): 0.299 Å
CMO chainID: N, resSeq: 606,

molecule: CARBON MONOXIDE

3ag3-A-515
sad. -0.64
ruf. +0.32
dom. +0.17
bre. -0.17
HIS chainID: A,
resSeq: 61,
molecule: Cytochrome c oxidase subunit 1
oxidoreductase
oligomeric count: 13
pocket vol.: 564.0 Å3
d(Fe-oop): 0.031 Å
HIS chainID: A, resSeq: 378,

molecule: Cytochrome c oxidase subunit 1

3ag3-A-516
sad. -0.44
ruf. -0.11
dom. +0.30
bre. +0.04
HIS chainID: A,
resSeq: 376,
molecule: Cytochrome c oxidase subunit 1
oxidoreductase
oligomeric count: 13
pocket vol.: 670.0 Å3
d(Fe-oop): 0.001 Å
NO chainID: A, resSeq: 520,

molecule: NITRIC OXIDE

3ag3-N-515
sad. -0.59
ruf. +0.35
dom. +0.19
bre. -0.13
HIS chainID: N,
resSeq: 61,
molecule: Cytochrome c oxidase subunit 1
oxidoreductase
oligomeric count: 13
pocket vol.: 597.0 Å3
d(Fe-oop): 0.003 Å
HIS chainID: N, resSeq: 378,

molecule: Cytochrome c oxidase subunit 1

3ag3-N-516
sad. -0.46
ruf. -0.07
dom. +0.29
bre. -0.07
HIS chainID: N,
resSeq: 376,
molecule: Cytochrome c oxidase subunit 1
oxidoreductase
oligomeric count: 13
pocket vol.: 687.0 Å3
d(Fe-oop): 0.009 Å
NO chainID: N, resSeq: 520,

molecule: NITRIC OXIDE

3ag4-A-515
sad. -0.64
ruf. +0.32
dom. +0.22
bre. -0.27
HIS chainID: A,
resSeq: 61,
molecule: Cytochrome c oxidase subunit 1
oxidoreductase
oligomeric count: 13
pocket vol.: 594.0 Å3
d(Fe-oop): 0.073 Å
HIS chainID: A, resSeq: 378,

molecule: Cytochrome c oxidase subunit 1

3ag4-A-516
sad. -0.45
ruf. +0.05
dom. +0.32
bre. +0.14
HIS chainID: A,
resSeq: 376,
molecule: Cytochrome c oxidase subunit 1
oxidoreductase
oligomeric count: 13
pocket vol.: 707.0 Å3
d(Fe-oop): 0.092 Å
CYN chainID: A, resSeq: 520,

molecule: CYANIDE ION

3ag4-N-515
sad. -0.55
ruf. +0.29
dom. +0.18
bre. -0.16
HIS chainID: N,
resSeq: 61,
molecule: Cytochrome c oxidase subunit 1
oxidoreductase
oligomeric count: 13
pocket vol.: 625.0 Å3
d(Fe-oop): 0.053 Å
HIS chainID: N, resSeq: 378,

molecule: Cytochrome c oxidase subunit 1

3ag4-N-516
sad. -0.40
ruf. +0.02
dom. +0.33
bre. +0.14
HIS chainID: N,
resSeq: 376,
molecule: Cytochrome c oxidase subunit 1
oxidoreductase
oligomeric count: 13
pocket vol.: 699.0 Å3
d(Fe-oop): 0.107 Å
CYN chainID: N, resSeq: 520,

molecule: CYANIDE ION

3aq5-A-144
sad. -0.32
ruf. +0.92
dom. +0.28
bre. -0.08
HIS chainID: A,
resSeq: 73,
molecule: Group 1 truncated hemoglobin
oxygen carrier
oligomeric count: 1
pocket vol.: 467.0 Å3
d(Fe-oop): 0.043 Å
OXY chainID: A, resSeq: 145,

molecule: OXYGEN MOLECULE

3aq5-B-144
sad. -0.28
ruf. +0.83
dom. +0.36
bre. -0.10
HIS chainID: B,
resSeq: 73,
molecule: Group 1 truncated hemoglobin
oxygen carrier
oligomeric count: 1
pocket vol.: 469.0 Å3
d(Fe-oop): 0.047 Å
OXY chainID: B, resSeq: 145,

molecule: OXYGEN MOLECULE

3aq6-A-144
sad. -0.27
ruf. +0.88
dom. +0.22
bre. +0.29
HIS chainID: A,
resSeq: 73,
molecule: Group 1 truncated hemoglobin
oxygen carrier
oligomeric count: 1
pocket vol.: 461.0 Å3
d(Fe-oop): 0.017 Å
HOH chainID: A, resSeq: 122,

molecule: water

3aq6-B-144
sad. -0.32
ruf. +0.92
dom. +0.33
bre. +0.07
HIS chainID: B,
resSeq: 73,
molecule: Group 1 truncated hemoglobin
oxygen carrier
oligomeric count: 1
pocket vol.: 470.0 Å3
d(Fe-oop): 0.016 Å
HOH chainID: B, resSeq: 123,

molecule: water

3aq7-A-144
sad. -0.28
ruf. +0.93
dom. +0.20
bre. +0.05
HIS chainID: A,
resSeq: 73,
molecule: Group 1 truncated hemoglobin
oxygen carrier
oligomeric count: 1
pocket vol.: 492.0 Å3
d(Fe-oop): 0.034 Å
HOH chainID: A, resSeq: 123,

molecule: water

3aq7-B-144
sad. -0.21
ruf. +0.78
dom. +0.31
bre. +0.02
HIS chainID: B,
resSeq: 73,
molecule: Group 1 truncated hemoglobin
oxygen carrier
oligomeric count: 1
pocket vol.: 484.0 Å3
d(Fe-oop): 0.010 Å
HOH chainID: B, resSeq: 122,

molecule: water