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ID of heme Axial ligands on heme Function & structure
7dy3-E-201
sad. +0.10
ruf. -0.07
dom. -0.22
bre. -0.20
TYR chainID: E,
resSeq: 87,
molecule: Hemoglobin subunit alpha
oxygen carrier
oligomeric count: 4
pocket vol.: 554.0 Å3
d(Fe-oop): 0.450 Å
Not assigned.
7dy3-F-201
sad. +0.15
ruf. +0.21
dom. -0.43
bre. -0.14
HIS chainID: F,
resSeq: 92,
molecule: Hemoglobin subunit beta
oxygen carrier
oligomeric count: 4
pocket vol.: 527.0 Å3
d(Fe-oop): 0.157 Å
HOH chainID: F, resSeq: 326,

molecule: water

7dy3-G-201
sad. +0.06
ruf. -0.03
dom. -0.26
bre. -0.18
TYR chainID: G,
resSeq: 87,
molecule: Hemoglobin subunit alpha
oxygen carrier
oligomeric count: 4
pocket vol.: 524.0 Å3
d(Fe-oop): 0.443 Å
Not assigned.
7dy3-H-201
sad. +0.31
ruf. +0.04
dom. -0.40
bre. -0.17
HIS chainID: H,
resSeq: 92,
molecule: Hemoglobin subunit beta
oxygen carrier
oligomeric count: 4
pocket vol.: 518.0 Å3
d(Fe-oop): 0.102 Å
HOH chainID: H, resSeq: 326,

molecule: water

7dy4-A-201
sad. +0.06
ruf. -0.30
dom. -0.01
bre. -0.16
TYR chainID: A,
resSeq: 58,
molecule: Hemoglobin subunit alpha
oxygen carrier
oligomeric count: 4
pocket vol.: 559.0 Å3
d(Fe-oop): 0.484 Å
Not assigned.
7dy4-B-201
sad. +0.29
ruf. +0.08
dom. -0.41
bre. -0.13
HIS chainID: B,
resSeq: 92,
molecule: Hemoglobin subunit beta
oxygen carrier
oligomeric count: 4
pocket vol.: 562.0 Å3
d(Fe-oop): 0.198 Å
HOH chainID: B, resSeq: 324,

molecule: water

7dy4-C-201
sad. +0.04
ruf. -0.36
dom. -0.01
bre. -0.17
TYR chainID: C,
resSeq: 58,
molecule: Hemoglobin subunit alpha
oxygen carrier
oligomeric count: 4
pocket vol.: 545.0 Å3
d(Fe-oop): 0.448 Å
Not assigned.
7dy4-D-201
sad. +0.28
ruf. +0.12
dom. -0.44
bre. -0.11
HIS chainID: D,
resSeq: 92,
molecule: Hemoglobin subunit beta
oxygen carrier
oligomeric count: 4
pocket vol.: 541.0 Å3
d(Fe-oop): 0.152 Å
HOH chainID: D, resSeq: 309,

molecule: water

7dy4-E-201
sad. +0.06
ruf. -0.34
dom. +0.01
bre. -0.15
TYR chainID: E,
resSeq: 58,
molecule: Hemoglobin subunit alpha
oxygen carrier
oligomeric count: 4
pocket vol.: 565.0 Å3
d(Fe-oop): 0.468 Å
Not assigned.
7dy4-F-201
sad. +0.21
ruf. +0.13
dom. -0.43
bre. -0.11
HIS chainID: F,
resSeq: 92,
molecule: Hemoglobin subunit beta
oxygen carrier
oligomeric count: 4
pocket vol.: 555.0 Å3
d(Fe-oop): 0.147 Å
HOH chainID: F, resSeq: 326,

molecule: water

7dy4-G-201
sad. +0.04
ruf. -0.31
dom. -0.03
bre. -0.12
TYR chainID: G,
resSeq: 58,
molecule: Hemoglobin subunit alpha
oxygen carrier
oligomeric count: 4
pocket vol.: 524.0 Å3
d(Fe-oop): 0.462 Å
Not assigned.
7dy4-H-201
sad. +0.27
ruf. +0.19
dom. -0.43
bre. -0.12
HIS chainID: H,
resSeq: 92,
molecule: Hemoglobin subunit beta
oxygen carrier
oligomeric count: 4
pocket vol.: 552.0 Å3
d(Fe-oop): 0.149 Å
HOH chainID: H, resSeq: 313,

molecule: water

7e0o-A-502
sad. -0.02
ruf. +0.16
dom. -0.27
bre. -0.01
HIS chainID: A,
resSeq: 346,
molecule: Indoleamine 2,3-dioxygenase 1
oxidoreductase
oligomeric count: 1
pocket vol.: 515.0 Å3
d(Fe-oop): 0.124 Å
HS0 chainID: A, resSeq: 501,

molecule: 6-bromanyl-1~{H}-indazol-4-amine

7e0o-B-502
sad. +0.33
ruf. -0.14
dom. -0.12
bre. -0.04
HIS chainID: B,
resSeq: 346,
molecule: Indoleamine 2,3-dioxygenase 1
oxidoreductase
oligomeric count: 1
pocket vol.: 555.0 Å3
d(Fe-oop): 0.151 Å
HS0 chainID: B, resSeq: 501,

molecule: 6-bromanyl-1~{H}-indazol-4-amine

7e0p-A-502
sad. +0.05
ruf. +0.70
dom. +0.09
bre. +0.39
HIS chainID: A,
resSeq: 346,
molecule: Indoleamine 2,3-dioxygenase 1
oxidoreductase
oligomeric count: 1
pocket vol.: 475.0 Å3
d(Fe-oop): 0.006 Å
HU0 chainID: A, resSeq: 501,

molecule: 4-[[(6-bromanyl-1~{H}-indazol-4-yl)amino]methyl]phenol

7e0p-B-502
sad. -0.34
ruf. -1.20
dom. +0.30
bre. +0.12
HIS chainID: B,
resSeq: 346,
molecule: Indoleamine 2,3-dioxygenase 1
oxidoreductase
oligomeric count: 1
pocket vol.: 496.0 Å3
d(Fe-oop): 0.007 Å
HU0 chainID: B, resSeq: 501,

molecule: 4-[[(6-bromanyl-1~{H}-indazol-4-yl)amino]methyl]phenol

7e0q-A-501
sad. +0.07
ruf. +0.48
dom. +0.17
bre. +0.14
HIS chainID: A,
resSeq: 346,
molecule: Indoleamine 2,3-dioxygenase 1
oxidoreductase
oligomeric count: 1
pocket vol.: 488.0 Å3
d(Fe-oop): 0.004 Å
HU3 chainID: A, resSeq: 502,

molecule: (1~{S},2~{R})-2-[[(6-bromanyl-1~{H}-indazol-4-yl)amino]methyl]cyclohexan-1-ol

7e0q-B-501
sad. +0.14
ruf. +0.59
dom. +0.10
bre. +0.06
HIS chainID: B,
resSeq: 346,
molecule: Indoleamine 2,3-dioxygenase 1
oxidoreductase
oligomeric count: 1
pocket vol.: 502.0 Å3
d(Fe-oop): 0.107 Å
HU3 chainID: B, resSeq: 502,

molecule: (1~{S},2~{R})-2-[[(6-bromanyl-1~{H}-indazol-4-yl)amino]methyl]cyclohexan-1-ol

7e0s-A-501
sad. +0.15
ruf. -0.43
dom. -0.20
bre. +0.05
HIS chainID: A,
resSeq: 346,
molecule: Indoleamine 2,3-dioxygenase 1
oxidoreductase
oligomeric count: 1
pocket vol.: 501.0 Å3
d(Fe-oop): 0.119 Å
HU6 chainID: A, resSeq: 502,

molecule: (1~{R},2~{S})-2-[[(6-bromanyl-1~{H}-indazol-4-yl)amino]methyl]cyclohexan-1-ol

7e0s-B-501
sad. +0.30
ruf. -0.55
dom. -0.05
bre. +0.04
HIS chainID: B,
resSeq: 346,
molecule: Indoleamine 2,3-dioxygenase 1
oxidoreductase
oligomeric count: 1
pocket vol.: 543.0 Å3
d(Fe-oop): 0.019 Å
HU6 chainID: B, resSeq: 502,

molecule: (1~{R},2~{S})-2-[[(6-bromanyl-1~{H}-indazol-4-yl)amino]methyl]cyclohexan-1-ol