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PyDISH No: 05162

PDB: 3b99,
chainID: A, resSeq: 600
heme type: B

distortion

Protein data

function: isomerase
experiment: X-RAY DIFFRACTION
resolution: 2.5 Å

axial ligand #1: CYS

chainID: A,
resSeq: 421,
Coordination distance[Å]: 2.289
molecule: Prostaglandin I2 synthase
EC number: 5.3.99.4
Organism: Danio rerio

axial ligand #2: U51

chainID: A,
resSeq: 700,
Coordination distance[Å]: 2.287
molecule: (5Z)-7-{(1R,4S,5R,6R)-6-[(1E)-oct-1-en-1-yl]-2,3-diazabicyclo[2.2.1]hept-2-en-5-yl}hept-5-enoic acid

List of other hemes in pdb:3b99

ID of heme	Distortion	Axial ligands on heme		Function & structure
3b99-B-600	`sad. -0.32 ruf. -0.41 dom. +0.20 bre. -0.15`	CYS	chainID: B, resSeq: 421, molecule: Prostaglandin I2 synthase	isomerase oligomeric count: 1 pocket vol.: 549.0 Å³ d(Fe-oop): 0.057 Å
3b99-B-600	`sad. -0.32 ruf. -0.41 dom. +0.20 bre. -0.15`	U51	chainID: B, resSeq: 700, molecule: (5Z)-7-{(1R,4S,5R,6R)-6-[(1E)-oct-1-en-1-yl]-2,3-diazabicyclo[2.2.1]hept-2-en-5-yl}hept-5-enoic acid