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ID of heme Axial ligands on heme Function & structure
6e1c-B-402
sad. +0.20
ruf. -1.10
dom. +0.38
bre. -0.52
HIS chainID: B,
resSeq: 227,
molecule: Di-heme enzyme
electron transporter
oligomeric count: 1
pocket vol.: 380.0 Å3
d(Fe-oop): 0.042 Å
TYR chainID: B, resSeq: 312,

molecule: Di-heme enzyme

6e35-A-501
sad. +0.38
ruf. +0.51
dom. -0.09
bre. -0.36
HIS chainID: A,
resSeq: 346,
molecule: Indoleamine 2,3-dioxygenase 1
oxidoreductase
oligomeric count: 2
pocket vol.: 507.0 Å3
d(Fe-oop): 0.048 Å
CYN chainID: A, resSeq: 502,

molecule: CYANIDE ION

6e35-B-501
sad. +0.34
ruf. +0.69
dom. -0.08
bre. -0.28
HIS chainID: B,
resSeq: 346,
molecule: Indoleamine 2,3-dioxygenase 1
oxidoreductase
oligomeric count: 2
pocket vol.: 510.0 Å3
d(Fe-oop): 0.037 Å
CYN chainID: B, resSeq: 502,

molecule: CYANIDE ION

6e40-A-501
sad. +0.30
ruf. +0.36
dom. -0.07
bre. -0.25
HIS chainID: A,
resSeq: 346,
molecule: Indoleamine 2,3-dioxygenase 1
oxidoreductase
oligomeric count: 1
pocket vol.: 499.0 Å3
d(Fe-oop): 0.039 Å
BBJ chainID: A, resSeq: 502,

molecule: N-(3-bromo-4-fluorophenyl)-N'-hydroxy-4-{[2-(sulfamoylamino)ethyl]amino}-1,2,5-oxadiazole-3-carboximidamide

6e40-B-501
sad. +0.38
ruf. +0.63
dom. -0.19
bre. -0.09
HIS chainID: B,
resSeq: 346,
molecule: Indoleamine 2,3-dioxygenase 1
oxidoreductase
oligomeric count: 1
pocket vol.: 502.0 Å3
d(Fe-oop): 0.120 Å
BBJ chainID: B, resSeq: 502,

molecule: N-(3-bromo-4-fluorophenyl)-N'-hydroxy-4-{[2-(sulfamoylamino)ethyl]amino}-1,2,5-oxadiazole-3-carboximidamide

6e40-C-501
sad. +0.41
ruf. +0.49
dom. -0.06
bre. -0.22
HIS chainID: C,
resSeq: 346,
molecule: Indoleamine 2,3-dioxygenase 1
oxidoreductase
oligomeric count: 1
pocket vol.: 518.0 Å3
d(Fe-oop): 0.264 Å
Not assigned.
6e40-D-501
sad. +0.17
ruf. +0.46
dom. +0.04
bre. -0.10
HIS chainID: D,
resSeq: 346,
molecule: Indoleamine 2,3-dioxygenase 1
oxidoreductase
oligomeric count: 1
pocket vol.: 513.0 Å3
d(Fe-oop): 0.123 Å
BBJ chainID: D, resSeq: 502,

molecule: N-(3-bromo-4-fluorophenyl)-N'-hydroxy-4-{[2-(sulfamoylamino)ethyl]amino}-1,2,5-oxadiazole-3-carboximidamide

6e41-A-501
sad. +0.30
ruf. +0.61
dom. +0.08
bre. -0.19
HIS chainID: A,
resSeq: 346,
molecule: Indoleamine 2,3-dioxygenase 1
oxidoreductase
oligomeric count: 1
pocket vol.: 532.0 Å3
d(Fe-oop): 0.042 Å
HQS chainID: A, resSeq: 502,

molecule: N-(3-bromo-4-fluorophenyl)-N'-hydroxy-4-{[2-(sulfamoylamino)ethyl]sulfanyl}-1,2,5-oxadiazole-3-carboximidamide

6e41-B-501
sad. +0.38
ruf. +0.68
dom. +0.01
bre. -0.11
HIS chainID: B,
resSeq: 346,
molecule: Indoleamine 2,3-dioxygenase 1
oxidoreductase
oligomeric count: 1
pocket vol.: 532.0 Å3
d(Fe-oop): 0.080 Å
HQS chainID: B, resSeq: 502,

molecule: N-(3-bromo-4-fluorophenyl)-N'-hydroxy-4-{[2-(sulfamoylamino)ethyl]sulfanyl}-1,2,5-oxadiazole-3-carboximidamide

6e41-C-501
sad. +0.31
ruf. +0.65
dom. +0.07
bre. -0.20
HIS chainID: C,
resSeq: 346,
molecule: Indoleamine 2,3-dioxygenase 1
oxidoreductase
oligomeric count: 1
pocket vol.: 528.0 Å3
d(Fe-oop): 0.057 Å
HQS chainID: C, resSeq: 502,

molecule: N-(3-bromo-4-fluorophenyl)-N'-hydroxy-4-{[2-(sulfamoylamino)ethyl]sulfanyl}-1,2,5-oxadiazole-3-carboximidamide

6e41-D-501
sad. +0.32
ruf. +0.75
dom. +0.00
bre. -0.11
HIS chainID: D,
resSeq: 346,
molecule: Indoleamine 2,3-dioxygenase 1
oxidoreductase
oligomeric count: 1
pocket vol.: 535.0 Å3
d(Fe-oop): 0.061 Å
HQS chainID: D, resSeq: 502,

molecule: N-(3-bromo-4-fluorophenyl)-N'-hydroxy-4-{[2-(sulfamoylamino)ethyl]sulfanyl}-1,2,5-oxadiazole-3-carboximidamide

6e42-A-501
sad. +0.42
ruf. -0.13
dom. -0.31
bre. -0.01
HIS chainID: A,
resSeq: 346,
molecule: Indoleamine 2,3-dioxygenase 1
oxidoreductase
oligomeric count: 1
pocket vol.: 491.0 Å3
d(Fe-oop): 0.073 Å
HQJ chainID: A, resSeq: 502,

molecule: 4-(3-chlorophenyl)-1H-imidazole

6e42-B-501
sad. +0.36
ruf. +0.13
dom. -0.26
bre. -0.07
HIS chainID: B,
resSeq: 346,
molecule: Indoleamine 2,3-dioxygenase 1
oxidoreductase
oligomeric count: 1
pocket vol.: 480.0 Å3
d(Fe-oop): 0.035 Å
HQJ chainID: B, resSeq: 502,

molecule: 4-(3-chlorophenyl)-1H-imidazole

6e42-C-501
sad. +0.31
ruf. +0.04
dom. -0.21
bre. -0.06
HIS chainID: C,
resSeq: 346,
molecule: Indoleamine 2,3-dioxygenase 1
oxidoreductase
oligomeric count: 1
pocket vol.: 497.0 Å3
d(Fe-oop): 0.042 Å
HQJ chainID: C, resSeq: 502,

molecule: 4-(3-chlorophenyl)-1H-imidazole

6e42-D-501
sad. +0.30
ruf. -0.00
dom. -0.29
bre. -0.07
HIS chainID: D,
resSeq: 346,
molecule: Indoleamine 2,3-dioxygenase 1
oxidoreductase
oligomeric count: 1
pocket vol.: 484.0 Å3
d(Fe-oop): 0.044 Å
HQJ chainID: D, resSeq: 502,

molecule: 4-(3-chlorophenyl)-1H-imidazole

6e44-A-501
sad. +0.44
ruf. -0.30
dom. -0.14
bre. -0.13
ALA chainID: A,
resSeq: 264,
molecule: Indoleamine 2,3-dioxygenase 1
oxidoreductase
oligomeric count: 1
pocket vol.: 462.0 Å3
d(Fe-oop): 0.004 Å
HIS chainID: A, resSeq: 346,

molecule: Indoleamine 2,3-dioxygenase 1

6e44-B-501
sad. +0.35
ruf. -0.40
dom. -0.18
bre. -0.06
HIS chainID: B,
resSeq: 346,
molecule: Indoleamine 2,3-dioxygenase 1
oxidoreductase
oligomeric count: 1
pocket vol.: 471.0 Å3
d(Fe-oop): 0.080 Å
Not assigned.
6e44-C-501
sad. +0.45
ruf. -0.23
dom. -0.15
bre. -0.11
ALA chainID: C,
resSeq: 264,
molecule: Indoleamine 2,3-dioxygenase 1
oxidoreductase
oligomeric count: 1
pocket vol.: 446.0 Å3
d(Fe-oop): 0.003 Å
HIS chainID: C, resSeq: 346,

molecule: Indoleamine 2,3-dioxygenase 1

6e44-D-501
sad. +0.46
ruf. -0.22
dom. -0.27
bre. -0.03
HIS chainID: D,
resSeq: 346,
molecule: Indoleamine 2,3-dioxygenase 1
oxidoreductase
oligomeric count: 1
pocket vol.: 476.0 Å3
d(Fe-oop): 0.088 Å
Not assigned.
6e45-A-501
sad. +0.51
ruf. -0.32
dom. -0.26
bre. -0.17
HIS chainID: A,
resSeq: 346,
molecule: Indoleamine 2,3-dioxygenase 1
oxidoreductase
oligomeric count: 1
pocket vol.: 472.0 Å3
d(Fe-oop): 0.226 Å
Not assigned.