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ID of heme Axial ligands on heme Function & structure
4uhi-D-540
sad. -0.06
ruf. -0.15
dom. +0.08
bre. +0.08
CYS chainID: D,
resSeq: 449,
molecule: STEROL 14-ALPHA DEMETHYLASE
oxidoreductase
oligomeric count: 4
pocket vol.: 435.0 Å3
d(Fe-oop): 0.012 Å
VFV chainID: D, resSeq: 580,

molecule: N-[(1R)-1-(3,4'-difluorobiphenyl-4-yl)-2-(1H-imidazol-1-yl)ethyl]-4-(5-phenyl-1,3,4-oxadiazol-2-yl)benzamide

4uhl-A-540
sad. -0.02
ruf. -0.31
dom. +0.06
bre. +0.04
CYS chainID: A,
resSeq: 449,
molecule: STEROL 14-ALPHA DEMETHYLASE
oxidoreductase
oligomeric count: 1
pocket vol.: 428.0 Å3
d(Fe-oop): 0.088 Å
VFV chainID: A, resSeq: 580,

molecule: N-[(1R)-1-(3,4'-difluorobiphenyl-4-yl)-2-(1H-imidazol-1-yl)ethyl]-4-(5-phenyl-1,3,4-oxadiazol-2-yl)benzamide

4uhl-B-540
sad. -0.11
ruf. -0.44
dom. +0.10
bre. +0.06
CYS chainID: B,
resSeq: 449,
molecule: STEROL 14-ALPHA DEMETHYLASE
oxidoreductase
oligomeric count: 1
pocket vol.: 433.0 Å3
d(Fe-oop): 0.062 Å
VFV chainID: B, resSeq: 580,

molecule: N-[(1R)-1-(3,4'-difluorobiphenyl-4-yl)-2-(1H-imidazol-1-yl)ethyl]-4-(5-phenyl-1,3,4-oxadiazol-2-yl)benzamide

4uhl-C-540
sad. -0.07
ruf. -0.46
dom. +0.08
bre. +0.06
CYS chainID: C,
resSeq: 449,
molecule: STEROL 14-ALPHA DEMETHYLASE
oxidoreductase
oligomeric count: 1
pocket vol.: 446.0 Å3
d(Fe-oop): 0.104 Å
VFV chainID: C, resSeq: 580,

molecule: N-[(1R)-1-(3,4'-difluorobiphenyl-4-yl)-2-(1H-imidazol-1-yl)ethyl]-4-(5-phenyl-1,3,4-oxadiazol-2-yl)benzamide

4uhl-D-540
sad. -0.08
ruf. -0.31
dom. +0.12
bre. +0.07
CYS chainID: D,
resSeq: 449,
molecule: STEROL 14-ALPHA DEMETHYLASE
oxidoreductase
oligomeric count: 1
pocket vol.: 434.0 Å3
d(Fe-oop): 0.089 Å
VFV chainID: D, resSeq: 580,

molecule: N-[(1R)-1-(3,4'-difluorobiphenyl-4-yl)-2-(1H-imidazol-1-yl)ethyl]-4-(5-phenyl-1,3,4-oxadiazol-2-yl)benzamide

4uhl-E-540
sad. -0.12
ruf. -0.36
dom. +0.12
bre. +0.06
CYS chainID: E,
resSeq: 449,
molecule: STEROL 14-ALPHA DEMETHYLASE
oxidoreductase
oligomeric count: 1
pocket vol.: 432.0 Å3
d(Fe-oop): 0.057 Å
VFV chainID: E, resSeq: 580,

molecule: N-[(1R)-1-(3,4'-difluorobiphenyl-4-yl)-2-(1H-imidazol-1-yl)ethyl]-4-(5-phenyl-1,3,4-oxadiazol-2-yl)benzamide

4uhl-F-540
sad. -0.09
ruf. -0.21
dom. +0.21
bre. +0.07
CYS chainID: F,
resSeq: 449,
molecule: STEROL 14-ALPHA DEMETHYLASE
oxidoreductase
oligomeric count: 1
pocket vol.: 438.0 Å3
d(Fe-oop): 0.077 Å
VFV chainID: F, resSeq: 580,

molecule: N-[(1R)-1-(3,4'-difluorobiphenyl-4-yl)-2-(1H-imidazol-1-yl)ethyl]-4-(5-phenyl-1,3,4-oxadiazol-2-yl)benzamide

4uhl-G-540
sad. -0.08
ruf. -0.27
dom. +0.10
bre. +0.07
CYS chainID: G,
resSeq: 449,
molecule: STEROL 14-ALPHA DEMETHYLASE
oxidoreductase
oligomeric count: 1
pocket vol.: 429.0 Å3
d(Fe-oop): 0.000 Å
VFV chainID: G, resSeq: 580,

molecule: N-[(1R)-1-(3,4'-difluorobiphenyl-4-yl)-2-(1H-imidazol-1-yl)ethyl]-4-(5-phenyl-1,3,4-oxadiazol-2-yl)benzamide

4uhl-H-540
sad. -0.07
ruf. -0.35
dom. +0.13
bre. +0.07
CYS chainID: H,
resSeq: 449,
molecule: STEROL 14-ALPHA DEMETHYLASE
oxidoreductase
oligomeric count: 1
pocket vol.: 435.0 Å3
d(Fe-oop): 0.065 Å
VFV chainID: H, resSeq: 580,

molecule: N-[(1R)-1-(3,4'-difluorobiphenyl-4-yl)-2-(1H-imidazol-1-yl)ethyl]-4-(5-phenyl-1,3,4-oxadiazol-2-yl)benzamide

4uii-A-200
sad. +0.18
ruf. +0.07
dom. +0.29
bre. -0.21
HIS chainID: A,
resSeq: 101,
molecule: GGDEF DOMAIN PROTEIN
transferase
oligomeric count: 2
pocket vol.: 742.0 Å3
d(Fe-oop): 0.253 Å
HOH chainID: A, resSeq: 2002,

molecule: water

4uii-B-200
sad. +0.21
ruf. -0.69
dom. +0.16
bre. -0.07
HIS chainID: B,
resSeq: 101,
molecule: GGDEF DOMAIN PROTEIN
transferase
oligomeric count: 2
pocket vol.: 794.0 Å3
d(Fe-oop): 0.256 Å
Not assigned.
4uiq-A-200
sad. +0.23
ruf. -0.81
dom. -0.23
bre. -0.05
HIS chainID: A,
resSeq: 99,
molecule: GLOBIN-COUPLED SENSOR WITH DIGUANYLATE CYCLASE ACTIVITY
transferase
oligomeric count: 2
pocket vol.: 451.0 Å3
d(Fe-oop): 0.178 Å
Not assigned.
4uiq-A-201
sad. +0.07
ruf. +0.13
dom. -0.03
bre. -0.11
HIS chainID: A,
resSeq: 155,
molecule: GLOBIN-COUPLED SENSOR WITH DIGUANYLATE CYCLASE ACTIVITY
transferase
oligomeric count: 2
pocket vol.: 776.0 Å3
d(Fe-oop): 0.021 Å
Not assigned.
4uiq-B-200
sad. +0.06
ruf. -0.80
dom. -0.20
bre. +0.04
HIS chainID: B,
resSeq: 99,
molecule: GLOBIN-COUPLED SENSOR WITH DIGUANYLATE CYCLASE ACTIVITY
transferase
oligomeric count: 2
pocket vol.: 546.0 Å3
d(Fe-oop): 0.030 Å
IMD chainID: B, resSeq: 1156,

molecule: IMIDAZOLE

4uiq-B-201
sad. -0.13
ruf. -0.00
dom. -0.13
bre. -0.11
HIS chainID: B,
resSeq: 155,
molecule: GLOBIN-COUPLED SENSOR WITH DIGUANYLATE CYCLASE ACTIVITY
transferase
oligomeric count: 2
pocket vol.: 753.0 Å3
d(Fe-oop): 0.013 Å
Not assigned.
4ulv-A-129
sad. -0.28
ruf. -0.35
dom. +0.03
bre. -0.30
HIS chainID: A,
resSeq: 122,
molecule: CYTOCHROME C, CLASS II
electron transporter
oligomeric count: 2
pocket vol.: 409.0 Å3
d(Fe-oop): 0.230 Å
Not assigned.
4ulv-B-129
sad. -0.27
ruf. -0.50
dom. +0.03
bre. -0.17
HIS chainID: B,
resSeq: 122,
molecule: CYTOCHROME C, CLASS II
electron transporter
oligomeric count: 2
pocket vol.: 427.0 Å3
d(Fe-oop): 0.189 Å
Not assigned.
4umz-A-1407
sad. -0.13
ruf. -0.54
dom. -0.02
bre. +0.16
CYS chainID: A,
resSeq: 354,
molecule: CYTOCHROME P450 HYDROXYLASE PIKC
oxidoreductase
oligomeric count: 1
pocket vol.: 396.0 Å3
d(Fe-oop): 0.023 Å
Not assigned.
4umz-B-1407
sad. -0.18
ruf. -0.53
dom. -0.08
bre. -0.03
CYS chainID: B,
resSeq: 354,
molecule: CYTOCHROME P450 HYDROXYLASE PIKC
oxidoreductase
oligomeric count: 1
pocket vol.: 386.0 Å3
d(Fe-oop): 0.027 Å
Not assigned.
4upm-A-750
sad. -0.45
ruf. -0.35
dom. +0.63
bre. -0.35
CYS chainID: A,
resSeq: 415,
molecule: NEURONAL NITRIC OXIDE SYNTHASE
oxidoreductase
oligomeric count: 2
pocket vol.: 530.0 Å3
d(Fe-oop): 0.381 Å
Not assigned.