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PyDISH No: 18627

PDB: 9esd,
chainID: A, resSeq: 401
heme type: B

distortion

Protein data

function: oxidoreductase
experiment: X-RAY DIFFRACTION
resolution: 2.103 Å
origomeric count: 4

axial ligand #1: HIS

chainID: A,
resSeq: 312,
Coordination distance[Å]: 2.175
molecule: Tryptophan 2,3-dioxygenase
EC number: 1.13.11.11
Organism: Drosophila melanogaster

axial ligand #2: 5PK

chainID: A,
resSeq: 402,
Coordination distance[Å]: 2.205
molecule: (1~{R})-1-cyclohexyl-2-[(5~{S})-5~{H}-imidazo[1,5-b]isoindol-5-yl]ethanol

List of other hemes in pdb:9esd

ID of heme	Distortion	Axial ligands on heme		Function & structure
9esd-B-401	`sad. -0.11 ruf. -0.47 dom. +0.05 bre. -0.27`	HIS	chainID: B, resSeq: 312, molecule: Tryptophan 2,3-dioxygenase	oxidoreductase oligomeric count: 4 pocket vol.: 549.0 Å³ d(Fe-oop): 0.043 Å
9esd-B-401	`sad. -0.11 ruf. -0.47 dom. +0.05 bre. -0.27`	5PK	chainID: B, resSeq: 402, molecule: (1~{R})-1-cyclohexyl-2-[(5~{S})-5~{H}-imidazo[1,5-b]isoindol-5-yl]ethanol
9esd-C-401	`sad. -0.06 ruf. -0.43 dom. +0.00 bre. -0.27`	HIS	chainID: C, resSeq: 312, molecule: Tryptophan 2,3-dioxygenase	oxidoreductase oligomeric count: 4 pocket vol.: 516.0 Å³ d(Fe-oop): 0.041 Å
9esd-C-401	`sad. -0.06 ruf. -0.43 dom. +0.00 bre. -0.27`	5PK	chainID: C, resSeq: 402, molecule: (1~{R})-1-cyclohexyl-2-[(5~{S})-5~{H}-imidazo[1,5-b]isoindol-5-yl]ethanol
9esd-D-401	`sad. -0.07 ruf. -0.51 dom. +0.04 bre. -0.27`	HIS	chainID: D, resSeq: 312, molecule: Tryptophan 2,3-dioxygenase	oxidoreductase oligomeric count: 4 pocket vol.: 540.0 Å³ d(Fe-oop): 0.080 Å
9esd-D-401	`sad. -0.07 ruf. -0.51 dom. +0.04 bre. -0.27`	5PK	chainID: D, resSeq: 402, molecule: (1~{R})-1-cyclohexyl-2-[(5~{S})-5~{H}-imidazo[1,5-b]isoindol-5-yl]ethanol