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PyDISH No: 02506

PDB: 1th3,
chainID: C, resSeq: 2002
heme type: B

function: oxidoreductase
experiment: X-RAY DIFFRACTION
resolution: 2.8 Å

chainID: C,
resSeq: 357,
Coordination distance[Å]: 1.757
molecule: Catalase
EC number: 1.11.1.6
Organism: Bos taurus

ID of heme	Distortion	Axial ligands on heme		Function & structure
1th3-A-2000	`sad. +0.37 ruf. +0.70 dom. +0.14 bre. -0.02`	TYR	chainID: A, resSeq: 357, molecule: Catalase	oxidoreductase oligomeric count: 4 pocket vol.: 409.0 Å³ d(Fe-oop): 0.307 Å
1th3-A-2000	`sad. +0.37 ruf. +0.70 dom. +0.14 bre. -0.02`	CYN	chainID: A, resSeq: 3000, molecule: CYANIDE ION
1th3-B-2001	`sad. -0.36 ruf. +0.50 dom. +0.89 bre. -0.23`	TYR	chainID: B, resSeq: 357, molecule: Catalase	oxidoreductase oligomeric count: 4 pocket vol.: 390.0 Å³ d(Fe-oop): 0.460 Å
1th3-B-2001	`sad. -0.36 ruf. +0.50 dom. +0.89 bre. -0.23`	Not assigned.
1th3-D-2003	`sad. +0.16 ruf. +0.04 dom. +0.74 bre. -0.08`	TYR	chainID: D, resSeq: 357, molecule: Catalase	oxidoreductase oligomeric count: 4 pocket vol.: 390.0 Å³ d(Fe-oop): 0.339 Å
1th3-D-2003	`sad. +0.16 ruf. +0.04 dom. +0.74 bre. -0.08`	CYN	chainID: D, resSeq: 3001, molecule: CYANIDE ION