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ID of heme Axial ligands on heme Function & structure
2h8f-A-200
sad. +0.06
ruf. -0.09
dom. -0.47
bre. -0.10
HIS chainID: A,
resSeq: 88,
molecule: Hemoglobin alpha subunit
oxygen carrier
oligomeric count: 4
pocket vol.: 521.0 Å3
d(Fe-oop): 0.261 Å
Not assigned.
2h8f-B-400
sad. +0.25
ruf. -0.06
dom. -0.36
bre. -0.13
HIS chainID: B,
resSeq: 92,
molecule: Hemoglobin beta subunit
oxygen carrier
oligomeric count: 4
pocket vol.: 575.0 Å3
d(Fe-oop): 0.260 Å
Not assigned.
2h8f-C-600
sad. +0.06
ruf. -0.16
dom. -0.36
bre. -0.13
HIS chainID: C,
resSeq: 88,
molecule: Hemoglobin alpha subunit
oxygen carrier
oligomeric count: 4
pocket vol.: 527.0 Å3
d(Fe-oop): 0.258 Å
Not assigned.
2h8f-D-800
sad. +0.24
ruf. -0.07
dom. -0.37
bre. -0.13
HIS chainID: D,
resSeq: 92,
molecule: Hemoglobin beta subunit
oxygen carrier
oligomeric count: 4
pocket vol.: 507.0 Å3
d(Fe-oop): 0.366 Å
Not assigned.
2hbc-A-142
sad. +0.60
ruf. -0.18
dom. -0.03
bre. -0.07
HIS chainID: A,
resSeq: 87,
molecule: HEMOGLOBIN A (ETHYL ISOCYANIDE) (ALPHA CHAIN)
oxygen carrier
oligomeric count: 4
pocket vol.: 552.0 Å3
d(Fe-oop): 0.063 Å
ENC chainID: A, resSeq: 143,

molecule: ETHYL ISOCYANIDE

2hbc-B-147
sad. +0.45
ruf. -0.13
dom. -0.34
bre. -0.08
HIS chainID: B,
resSeq: 92,
molecule: HEMOGLOBIN A (ETHYL ISOCYANIDE) (BETA CHAIN)
oxygen carrier
oligomeric count: 4
pocket vol.: 542.0 Å3
d(Fe-oop): 0.097 Å
ENC chainID: B, resSeq: 148,

molecule: ETHYL ISOCYANIDE

2hbd-A-142
sad. +0.34
ruf. -0.05
dom. -0.10
bre. -0.16
HIS chainID: A,
resSeq: 87,
molecule: HEMOGLOBIN A (METHYL ISOCYANIDE) (ALPHA CHAIN)
oxygen carrier
oligomeric count: 4
pocket vol.: 522.0 Å3
d(Fe-oop): 0.097 Å
MNC chainID: A, resSeq: 143,

molecule: METHYL ISOCYANIDE

2hbd-B-147
sad. +0.33
ruf. +0.05
dom. -0.39
bre. -0.28
HIS chainID: B,
resSeq: 92,
molecule: HEMOGLOBIN A (METHYL ISOCYANIDE) (BETA CHAIN)
oxygen carrier
oligomeric count: 4
pocket vol.: 534.0 Å3
d(Fe-oop): 0.035 Å
MNC chainID: B, resSeq: 148,

molecule: METHYL ISOCYANIDE

2hbe-A-142
sad. +0.60
ruf. -0.10
dom. -0.01
bre. -0.17
HIS chainID: A,
resSeq: 87,
molecule: HEMOGLOBIN A (N-BUTYL ISOCYANIDE) (ALPHA CHAIN)
oxygen carrier
oligomeric count: 4
pocket vol.: 527.0 Å3
d(Fe-oop): 0.007 Å
NBN chainID: A, resSeq: 143,

molecule: N-BUTYL ISOCYANIDE

2hbe-B-147
sad. +0.34
ruf. -0.11
dom. -0.42
bre. -0.14
HIS chainID: B,
resSeq: 92,
molecule: HEMOGLOBIN A (N-BUTYL ISOCYANIDE) (BETA CHAIN)
oxygen carrier
oligomeric count: 4
pocket vol.: 546.0 Å3
d(Fe-oop): 0.009 Å
NBN chainID: B, resSeq: 148,

molecule: N-BUTYL ISOCYANIDE

2hbf-A-142
sad. +0.49
ruf. -0.09
dom. -0.05
bre. -0.10
HIS chainID: A,
resSeq: 87,
molecule: HEMOGLOBIN A (N-PROPYL ISOCYANIDE) (ALPHA CHAIN)
oxygen carrier
oligomeric count: 4
pocket vol.: 542.0 Å3
d(Fe-oop): 0.011 Å
NPN chainID: A, resSeq: 143,

molecule: N-PROPYL ISOCYANIDE

2hbf-B-147
sad. +0.27
ruf. -0.07
dom. -0.33
bre. -0.17
HIS chainID: B,
resSeq: 92,
molecule: HEMOGLOBIN A (N-PROPYL ISOCYANIDE) (BETA CHAIN)
oxygen carrier
oligomeric count: 4
pocket vol.: 562.0 Å3
d(Fe-oop): 0.155 Å
NPN chainID: B, resSeq: 148,

molecule: N-PROPYL ISOCYANIDE

2hbg-A-148
sad. -0.08
ruf. -0.32
dom. +0.41
bre. -0.11
HIS chainID: A,
resSeq: 90,
molecule: HEMOGLOBIN (DEOXY)
oxygen carrier
oligomeric count: 1
pocket vol.: 523.0 Å3
d(Fe-oop): 0.285 Å
Not assigned.
2hbs-A-153
sad. +0.50
ruf. -0.43
dom. -0.77
bre. +0.09
HIS chainID: A,
resSeq: 87,
molecule: HEMOGLOBIN S (DEOXY), ALPHA CHAIN
oxygen carrier
oligomeric count: 4
pocket vol.: 558.0 Å3
d(Fe-oop): 0.381 Å
Not assigned.
2hbs-B-153
sad. +0.45
ruf. -0.04
dom. -0.58
bre. -0.09
HIS chainID: B,
resSeq: 92,
molecule: HEMOGLOBIN S (DEOXY), BETA CHAIN
oxygen carrier
oligomeric count: 4
pocket vol.: 581.0 Å3
d(Fe-oop): 0.433 Å
Not assigned.
2hbs-C-153
sad. +0.13
ruf. -0.46
dom. -0.56
bre. +0.03
HIS chainID: C,
resSeq: 87,
molecule: HEMOGLOBIN S (DEOXY), ALPHA CHAIN
oxygen carrier
oligomeric count: 4
pocket vol.: 569.0 Å3
d(Fe-oop): 0.348 Å
Not assigned.
2hbs-D-153
sad. +0.23
ruf. +0.09
dom. -0.35
bre. -0.15
HIS chainID: D,
resSeq: 92,
molecule: HEMOGLOBIN S (DEOXY), BETA CHAIN
oxygen carrier
oligomeric count: 4
pocket vol.: 594.0 Å3
d(Fe-oop): 0.250 Å
Not assigned.
2hbs-E-153
sad. +0.10
ruf. -0.24
dom. -0.65
bre. -0.13
HIS chainID: E,
resSeq: 87,
molecule: HEMOGLOBIN S (DEOXY), ALPHA CHAIN
oxygen carrier
oligomeric count: 4
pocket vol.: 581.0 Å3
d(Fe-oop): 0.272 Å
Not assigned.
2hbs-F-153
sad. +0.43
ruf. +0.12
dom. -0.66
bre. -0.18
HIS chainID: F,
resSeq: 92,
molecule: HEMOGLOBIN S (DEOXY), BETA CHAIN
oxygen carrier
oligomeric count: 4
pocket vol.: 578.0 Å3
d(Fe-oop): 0.394 Å
Not assigned.
2hbs-G-153
sad. +0.21
ruf. -0.49
dom. -0.58
bre. -0.06
HIS chainID: G,
resSeq: 87,
molecule: HEMOGLOBIN S (DEOXY), ALPHA CHAIN
oxygen carrier
oligomeric count: 4
pocket vol.: 563.0 Å3
d(Fe-oop): 0.299 Å
Not assigned.