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ID of heme Axial ligands on heme Function & structure
9cjg-B-401
sad. -0.42
ruf. +0.35
dom. +0.23
bre. +0.08
SER chainID: B,
resSeq: 341,
molecule: Cytochrome P450-G9
oxidoreductase
oligomeric count: 1
pocket vol.: 379.0 Å3
d(Fe-oop): 0.048 Å
Not assigned.
9clo-A-901
sad. +0.26
ruf. +0.09
dom. -0.76
bre. -0.13
Not assigned. unclassified
oligomeric count: 2
pocket vol.: 596.0 Å3
d(Fe-oop): 0.015 Å
Not assigned.
9clo-B-902
sad. +0.39
ruf. +0.33
dom. -0.58
bre. -0.14
HIS chainID: B,
resSeq: 77,
molecule: Oxygen sensor protein DosP
hydrolase
oligomeric count: 2
pocket vol.: 557.0 Å3
d(Fe-oop): 0.078 Å
Not assigned.
9cmf-A-901
sad. -0.13
ruf. +0.37
dom. -0.19
bre. -0.06
Not assigned. unclassified
oligomeric count: 2
pocket vol.: 649.0 Å3
d(Fe-oop): 0.046 Å
Not assigned.
9cmf-B-901
sad. -0.24
ruf. -0.53
dom. -0.51
bre. -0.07
HIS chainID: B,
resSeq: 77,
molecule: Oxygen sensor protein DosP
hydrolase
oligomeric count: 2
pocket vol.: 637.0 Å3
d(Fe-oop): 0.020 Å
Not assigned.
9cor-A-601
sad. -0.21
ruf. +0.03
dom. -0.07
bre. -0.23
CYS chainID: A,
resSeq: 442,
molecule: Cytochrome P450 3A4
oxidoreductase
oligomeric count: 2
pocket vol.: 420.0 Å3
d(Fe-oop): 0.083 Å
A1A07 chainID: A, resSeq: 602,

molecule: (2R)-3-phenyl-2-{[(2S)-3-phenyl-2-{[N-(trifluoroacetyl)glycyl]amino}propyl]sulfanyl}-N-[2-(pyridin-3-yl)ethyl]propanamide

9cos-A-601
sad. -0.19
ruf. +0.13
dom. -0.02
bre. -0.21
CYS chainID: A,
resSeq: 442,
molecule: Cytochrome P450 3A4
oxidoreductase
oligomeric count: 2
pocket vol.: 403.0 Å3
d(Fe-oop): 0.117 Å
A1A06 chainID: A, resSeq: 602,

molecule: (2R)-3-phenyl-2-{[(2S)-3-phenyl-2-{[N-(trifluoroacetyl)glycyl]amino}propyl]sulfanyl}-N-[3-(pyridin-3-yl)propyl]propanamide

9cot-A-601
sad. -0.22
ruf. +0.11
dom. +0.05
bre. -0.23
CYS chainID: A,
resSeq: 442,
molecule: Cytochrome P450 3A4
oxidoreductase
oligomeric count: 2
pocket vol.: 422.0 Å3
d(Fe-oop): 0.032 Å
A1A08 chainID: A, resSeq: 602,

molecule: (2R)-3-phenyl-2-{[(2S)-3-phenyl-2-(2,2,2-trifluoroacetamido)propyl]sulfanyl}-N-[3-(pyridin-3-yl)propyl]propanamide

9cou-A-601
sad. -0.23
ruf. +0.05
dom. +0.05
bre. -0.22
CYS chainID: A,
resSeq: 442,
molecule: Cytochrome P450 3A4
oxidoreductase
oligomeric count: 2
pocket vol.: 424.0 Å3
d(Fe-oop): 0.018 Å
A1A4U chainID: A, resSeq: 602,

molecule: (2R)-2-{[(2S)-2-(benzenesulfonamido)-3-phenylpropyl]sulfanyl}-3-phenyl-N-[3-(pyridin-3-yl)propyl]propanamide

9cov-A-601
sad. -0.32
ruf. +0.16
dom. +0.01
bre. -0.24
CYS chainID: A,
resSeq: 442,
molecule: Cytochrome P450 3A4
oxidoreductase
oligomeric count: 2
pocket vol.: 409.0 Å3
d(Fe-oop): 0.091 Å
A1A4S chainID: A, resSeq: 602,

molecule: N-[(2S)-1-(1H-indol-3-yl)-3-{[(2R)-1-oxo-3-phenyl-1-{[3-(pyridin-3-yl)propyl]amino}propan-2-yl]sulfanyl}propan-2-yl]pyridine-3-carboxamide

9cow-A-601
sad. -0.16
ruf. -0.14
dom. +0.05
bre. -0.22
CYS chainID: A,
resSeq: 442,
molecule: Cytochrome P450 3A4
oxidoreductase
oligomeric count: 2
pocket vol.: 415.0 Å3
d(Fe-oop): 0.053 Å
A1A4V chainID: A, resSeq: 603,

molecule: N-[(2S)-1-(naphthalen-1-yl)-3-{[(2R)-1-oxo-3-phenyl-1-{[3-(pyridin-3-yl)propyl]amino}propan-2-yl]sulfanyl}propan-2-yl]pyridine-3-carboxamide

9cox-A-601
sad. -0.18
ruf. +0.09
dom. +0.10
bre. -0.23
CYS chainID: A,
resSeq: 442,
molecule: Cytochrome P450 3A4
oxidoreductase
oligomeric count: 2
pocket vol.: 418.0 Å3
d(Fe-oop): 0.040 Å
A1A4K chainID: A, resSeq: 602,

molecule: N-[(2S)-1-(naphthalen-1-yl)-3-{[(2S)-1-oxo-3-phenyl-1-{[3-(pyridin-3-yl)propyl]amino}propan-2-yl]sulfanyl}propan-2-yl]pyridine-3-carboxamide

9coy-A-601
sad. -0.30
ruf. +0.20
dom. +0.07
bre. -0.18
CYS chainID: A,
resSeq: 442,
molecule: Cytochrome P450 3A4
oxidoreductase
oligomeric count: 2
pocket vol.: 417.0 Å3
d(Fe-oop): 0.070 Å
A1A4T chainID: A, resSeq: 602,

molecule: N-[(2S)-1-([1,1'-biphenyl]-4-yl)-3-{[(2R)-1-oxo-3-phenyl-1-{[3-(pyridin-3-yl)propyl]amino}propan-2-yl]sulfanyl}propan-2-yl]-2,2-dimethylpropanamide

9cqm-A-201
sad. +0.19
ruf. -0.24
dom. -0.37
bre. -0.19
HIS chainID: A,
resSeq: 87,
molecule: Hemoglobin subunit alpha
oxygen carrier
oligomeric count: 4
pocket vol.: 523.0 Å3
d(Fe-oop): 0.001 Å
OXY chainID: A, resSeq: 202,

molecule: OXYGEN MOLECULE

9cqm-B-201
sad. +0.24
ruf. -0.38
dom. -0.37
bre. -0.19
HIS chainID: B,
resSeq: 92,
molecule: Hemoglobin subunit beta
oxygen carrier
oligomeric count: 4
pocket vol.: 527.0 Å3
d(Fe-oop): 0.008 Å
OXY chainID: B, resSeq: 202,

molecule: OXYGEN MOLECULE

9cqm-C-201
sad. +0.25
ruf. -0.27
dom. -0.21
bre. +0.04
HIS chainID: C,
resSeq: 87,
molecule: Hemoglobin subunit alpha
oxygen carrier
oligomeric count: 4
pocket vol.: 544.0 Å3
d(Fe-oop): 0.004 Å
OXY chainID: C, resSeq: 202,

molecule: OXYGEN MOLECULE

9cqm-D-201
sad. +0.23
ruf. -0.38
dom. -0.37
bre. -0.18
HIS chainID: D,
resSeq: 92,
molecule: Hemoglobin subunit beta
oxygen carrier
oligomeric count: 4
pocket vol.: 529.0 Å3
d(Fe-oop): 0.027 Å
OXY chainID: D, resSeq: 202,

molecule: OXYGEN MOLECULE

9cqn-A-201
sad. +0.19
ruf. -0.24
dom. -0.37
bre. -0.19
HIS chainID: A,
resSeq: 87,
molecule: Hemoglobin subunit alpha
oxygen carrier
oligomeric count: 4
pocket vol.: 523.0 Å3
d(Fe-oop): 0.001 Å
OXY chainID: A, resSeq: 202,

molecule: OXYGEN MOLECULE

9cqn-B-201
sad. +0.24
ruf. -0.38
dom. -0.37
bre. -0.19
HIS chainID: B,
resSeq: 92,
molecule: Hemoglobin subunit beta
oxygen carrier
oligomeric count: 4
pocket vol.: 527.0 Å3
d(Fe-oop): 0.008 Å
OXY chainID: B, resSeq: 202,

molecule: OXYGEN MOLECULE

9cqn-C-201
sad. +0.25
ruf. -0.27
dom. -0.21
bre. +0.04
HIS chainID: C,
resSeq: 87,
molecule: Hemoglobin subunit alpha
oxygen carrier
oligomeric count: 4
pocket vol.: 544.0 Å3
d(Fe-oop): 0.004 Å
OXY chainID: C, resSeq: 202,

molecule: OXYGEN MOLECULE