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PyDISH No: 03578

PDB: 2fdv,
chainID: C, resSeq: 500
heme type: B

distortion

Protein data

function: oxidoreductase
experiment: X-RAY DIFFRACTION
resolution: 1.65 Å

axial ligand #1: CYS

chainID: C,
resSeq: 439,
Coordination distance[Å]: 2.295
molecule: Cytochrome P450 2A6
EC number: 1.14.14.1
Organism: Homo sapiens

axial ligand #2: D2G

chainID: C,
resSeq: 501,
Coordination distance[Å]: 2.162
molecule: N-METHYL(5-(PYRIDIN-3-YL)FURAN-2-YL)METHANAMINE

List of other hemes in pdb:2fdv

ID of heme	Distortion	Axial ligands on heme		Function & structure
2fdv-A-500	`sad. -0.21 ruf. -0.31 dom. -0.05 bre. -0.13`	CYS	chainID: A, resSeq: 439, molecule: Cytochrome P450 2A6	oxidoreductase oligomeric count: 1 pocket vol.: 419.0 Å³ d(Fe-oop): 0.055 Å
2fdv-A-500	`sad. -0.21 ruf. -0.31 dom. -0.05 bre. -0.13`	D2G	chainID: A, resSeq: 501, molecule: N-METHYL(5-(PYRIDIN-3-YL)FURAN-2-YL)METHANAMINE
2fdv-B-500	`sad. -0.17 ruf. -0.26 dom. +0.05 bre. -0.10`	CYS	chainID: B, resSeq: 439, molecule: Cytochrome P450 2A6	oxidoreductase oligomeric count: 1 pocket vol.: 422.0 Å³ d(Fe-oop): 0.069 Å
2fdv-B-500	`sad. -0.17 ruf. -0.26 dom. +0.05 bre. -0.10`	D2G	chainID: B, resSeq: 501, molecule: N-METHYL(5-(PYRIDIN-3-YL)FURAN-2-YL)METHANAMINE
2fdv-D-500	`sad. -0.23 ruf. -0.38 dom. -0.10 bre. -0.16`	CYS	chainID: D, resSeq: 439, molecule: Cytochrome P450 2A6	oxidoreductase oligomeric count: 1 pocket vol.: 407.0 Å³ d(Fe-oop): 0.051 Å
2fdv-D-500	`sad. -0.23 ruf. -0.38 dom. -0.10 bre. -0.16`	D2G	chainID: D, resSeq: 501, molecule: N-METHYL(5-(PYRIDIN-3-YL)FURAN-2-YL)METHANAMINE