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PyDISH No: 09418

PDB: 4pxh,
chainID: A, resSeq: 501
heme type: B

distortion

Protein data

function: oxidoreductase
experiment: X-RAY DIFFRACTION
resolution: 2.7 Å

axial ligand #1: CYS

chainID: A,
resSeq: 357,
Coordination distance[Å]: 2.333
molecule: P450 monooxygenase
EC number: 1.14.14.1
Organism: Streptomyces sp. Acta 2897

axial ligand #2: KH4

chainID: B,
resSeq: 101,
Coordination distance[Å]: 1.989
molecule: S-[2-({N-[(2R)-2-hydroxy-3,3-dimethyl-4-(phosphonooxy)butanoyl]-beta-alanyl}amino)ethyl] 1H-imidazole-4-carbothioate

List of other hemes in pdb:4pxh

ID of heme Distortion Axial ligands on heme Function & structure
4pxh-C-501
sad. -0.60
ruf. -0.88
dom. +0.02
bre. -0.25
CYS chainID: C,
resSeq: 357,
molecule: P450 monooxygenase
oxidoreductase
oligomeric count: 2
pocket vol.: 415.0 Å3
d(Fe-oop): 0.005 Å
KH4 chainID: D, resSeq: 101,
molecule: S-[2-({N-[(2R)-2-hydroxy-3,3-dimethyl-4-(phosphonooxy)butanoyl]-beta-alanyl}amino)ethyl] 1H-imidazole-4-carbothioate
4pxh-E-501
sad. -0.51
ruf. -0.75
dom. +0.06
bre. -0.25
CYS chainID: E,
resSeq: 357,
molecule: P450 monooxygenase
oxidoreductase
oligomeric count: 2
pocket vol.: 414.0 Å3
d(Fe-oop): 0.004 Å
KH4 chainID: F, resSeq: 101,
molecule: S-[2-({N-[(2R)-2-hydroxy-3,3-dimethyl-4-(phosphonooxy)butanoyl]-beta-alanyl}amino)ethyl] 1H-imidazole-4-carbothioate