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ID of heme Axial ligands on heme Function & structure
8ed4-I-200
sad. +0.03
ruf. -0.74
dom. -0.05
bre. -0.02
HIS chainID: I,
resSeq: 38,
molecule: C-type cytochrome c552
electron transporter
oligomeric count: 6
pocket vol.: 331.0 Å3
d(Fe-oop): 0.026 Å
MET chainID: I, resSeq: 103,

molecule: C-type cytochrome c552

8ed4-J-200
sad. +0.00
ruf. -0.55
dom. +0.21
bre. -0.08
HIS chainID: J,
resSeq: 38,
molecule: C-type cytochrome c552
electron transporter
oligomeric count: 6
pocket vol.: 368.0 Å3
d(Fe-oop): 0.071 Å
MET chainID: J, resSeq: 103,

molecule: C-type cytochrome c552

8ed4-K-200
sad. +0.08
ruf. -0.56
dom. -0.07
bre. -0.03
HIS chainID: K,
resSeq: 38,
molecule: C-type cytochrome c552
electron transporter
oligomeric count: 6
pocket vol.: 318.0 Å3
d(Fe-oop): 0.030 Å
MET chainID: K, resSeq: 103,

molecule: C-type cytochrome c552

8ed4-L-200
sad. -0.01
ruf. -0.80
dom. +0.07
bre. -0.09
HIS chainID: L,
resSeq: 38,
molecule: C-type cytochrome c552
electron transporter
oligomeric count: 6
pocket vol.: 339.0 Å3
d(Fe-oop): 0.012 Å
MET chainID: L, resSeq: 103,

molecule: C-type cytochrome c552

8egi-A-202
sad. +0.24
ruf. -0.35
dom. -0.36
bre. -0.29
HIS chainID: A,
resSeq: 87,
molecule: Hemoglobin subunit alpha
oxygen carrier
oligomeric count: 4
pocket vol.: 523.0 Å3
d(Fe-oop): 0.100 Å
CMO chainID: A, resSeq: 201,

molecule: CARBON MONOXIDE

8egi-B-202
sad. +0.25
ruf. -0.24
dom. -0.27
bre. -0.38
HIS chainID: B,
resSeq: 92,
molecule: Hemoglobin subunit beta
oxygen carrier
oligomeric count: 4
pocket vol.: 570.0 Å3
d(Fe-oop): 0.157 Å
CMO chainID: B, resSeq: 201,

molecule: CARBON MONOXIDE

8egi-C-202
sad. +0.40
ruf. -0.08
dom. -0.38
bre. -0.28
HIS chainID: C,
resSeq: 87,
molecule: Hemoglobin subunit alpha
oxygen carrier
oligomeric count: 4
pocket vol.: 565.0 Å3
d(Fe-oop): 0.085 Å
CMO chainID: C, resSeq: 201,

molecule: CARBON MONOXIDE

8egi-D-202
sad. +0.17
ruf. -0.22
dom. -0.20
bre. -0.37
HIS chainID: D,
resSeq: 92,
molecule: Hemoglobin subunit beta
oxygen carrier
oligomeric count: 4
pocket vol.: 527.0 Å3
d(Fe-oop): 0.112 Å
CMO chainID: D, resSeq: 201,

molecule: CARBON MONOXIDE

8ejn-A-201
sad. +0.06
ruf. +0.07
dom. -0.36
bre. -0.14
HIS chainID: A,
resSeq: 89,
molecule: Dehaloperoxidase A
oxygen carrier
oligomeric count: 1
pocket vol.: 484.0 Å3
d(Fe-oop): 0.132 Å
HOH chainID: A, resSeq: 379,

molecule: water

8ejn-B-201
sad. +0.18
ruf. -0.01
dom. -0.37
bre. -0.05
HIS chainID: B,
resSeq: 89,
molecule: Dehaloperoxidase A
oxygen carrier
oligomeric count: 1
pocket vol.: 482.0 Å3
d(Fe-oop): 0.158 Å
HOH chainID: B, resSeq: 313,

molecule: water

8eko-A-201
sad. +0.20
ruf. -0.08
dom. -0.18
bre. -0.14
HIS chainID: A,
resSeq: 93,
molecule: Myoglobin
oxygen carrier
oligomeric count: 1
pocket vol.: 531.0 Å3
d(Fe-oop): 0.052 Å
HOH chainID: A, resSeq: 349,

molecule: water

8ekt-A-501
sad. -0.05
ruf. -0.21
dom. -0.06
bre. +0.02
CYS chainID: A,
resSeq: 434,
molecule: sterol 14a-demethylase
oxidoreductase
oligomeric count: 1
pocket vol.: 459.0 Å3
d(Fe-oop): 0.050 Å
VT1 chainID: A, resSeq: 502,

molecule: (R)-2-(2,4-Difluorophenyl)-1,1-difluoro-3-(1H-tetrazol-1-yl)-1-(5-(4-(2,2,2-trifluoroethoxy)phenyl)pyridin-2-yl)propan-2-ol

8ekt-B-501
sad. +0.00
ruf. -0.17
dom. -0.03
bre. +0.08
CYS chainID: B,
resSeq: 434,
molecule: sterol 14a-demethylase
oxidoreductase
oligomeric count: 1
pocket vol.: 457.0 Å3
d(Fe-oop): 0.025 Å
VT1 chainID: B, resSeq: 502,

molecule: (R)-2-(2,4-Difluorophenyl)-1,1-difluoro-3-(1H-tetrazol-1-yl)-1-(5-(4-(2,2,2-trifluoroethoxy)phenyl)pyridin-2-yl)propan-2-ol

8ekt-C-501
sad. +0.06
ruf. -0.22
dom. -0.09
bre. +0.02
CYS chainID: C,
resSeq: 434,
molecule: sterol 14a-demethylase
oxidoreductase
oligomeric count: 1
pocket vol.: 439.0 Å3
d(Fe-oop): 0.022 Å
VT1 chainID: C, resSeq: 502,

molecule: (R)-2-(2,4-Difluorophenyl)-1,1-difluoro-3-(1H-tetrazol-1-yl)-1-(5-(4-(2,2,2-trifluoroethoxy)phenyl)pyridin-2-yl)propan-2-ol

8ekt-D-501
sad. +0.17
ruf. -0.33
dom. -0.17
bre. -0.01
CYS chainID: D,
resSeq: 434,
molecule: sterol 14a-demethylase
oxidoreductase
oligomeric count: 1
pocket vol.: 449.0 Å3
d(Fe-oop): 0.025 Å
VT1 chainID: D, resSeq: 502,

molecule: (R)-2-(2,4-Difluorophenyl)-1,1-difluoro-3-(1H-tetrazol-1-yl)-1-(5-(4-(2,2,2-trifluoroethoxy)phenyl)pyridin-2-yl)propan-2-ol

8ekt-E-501
sad. +0.04
ruf. -0.48
dom. -0.05
bre. +0.06
CYS chainID: E,
resSeq: 434,
molecule: sterol 14a-demethylase
oxidoreductase
oligomeric count: 1
pocket vol.: 472.0 Å3
d(Fe-oop): 0.017 Å
VT1 chainID: E, resSeq: 502,

molecule: (R)-2-(2,4-Difluorophenyl)-1,1-difluoro-3-(1H-tetrazol-1-yl)-1-(5-(4-(2,2,2-trifluoroethoxy)phenyl)pyridin-2-yl)propan-2-ol

8ekt-F-501
sad. +0.10
ruf. -0.39
dom. -0.14
bre. +0.08
CYS chainID: F,
resSeq: 434,
molecule: sterol 14a-demethylase
oxidoreductase
oligomeric count: 1
pocket vol.: 448.0 Å3
d(Fe-oop): 0.029 Å
VT1 chainID: F, resSeq: 502,

molecule: (R)-2-(2,4-Difluorophenyl)-1,1-difluoro-3-(1H-tetrazol-1-yl)-1-(5-(4-(2,2,2-trifluoroethoxy)phenyl)pyridin-2-yl)propan-2-ol

8el9-A-601
sad. -0.10
ruf. +0.52
dom. +0.48
bre. -0.17
TYR chainID: A,
resSeq: 358,
molecule: Catalase
oxidoreductase
oligomeric count: 4
pocket vol.: 403.0 Å3
d(Fe-oop): 0.058 Å
Not assigned.
8el9-B-601
sad. -0.07
ruf. +0.60
dom. +0.51
bre. -0.14
TYR chainID: B,
resSeq: 358,
molecule: Catalase
oxidoreductase
oligomeric count: 4
pocket vol.: 406.0 Å3
d(Fe-oop): 0.065 Å
Not assigned.
8el9-C-601
sad. -0.09
ruf. +0.61
dom. +0.51
bre. -0.13
TYR chainID: C,
resSeq: 358,
molecule: Catalase
oxidoreductase
oligomeric count: 4
pocket vol.: 399.0 Å3
d(Fe-oop): 0.073 Å
Not assigned.