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PyDISH No: 10290

PDB: 4zgx,
chainID: J, resSeq: 601
heme type: B

distortion

Protein data

function: oxidoreductase
experiment: X-RAY DIFFRACTION
resolution: 3.2 Å

axial ligand #1: CYS

chainID: J,
resSeq: 450,
Coordination distance[Å]: 2.758
molecule: Cytochrome P450 11B2, mitochondrial
EC number: 1.14.15.4,1.14.15.5
Organism: Homo sapiens

axial ligand #2: QHC

chainID: J,
resSeq: 602,
Coordination distance[Å]: 2.188
molecule: N-[(8R)-4-(4-chloro-3-fluorophenyl)-5,6,7,8-tetrahydroisoquinolin-8-yl]propanamide

List of other hemes in pdb:4zgx

ID of heme	Distortion	Axial ligands on heme		Function & structure
4zgx-A-601	`sad. +0.11 ruf. -0.38 dom. +0.21 bre. +0.08`	CYS	chainID: A, resSeq: 450, molecule: Cytochrome P450 11B2, mitochondrial	oxidoreductase oligomeric count: 1 pocket vol.: 423.0 Å³ d(Fe-oop): 0.202 Å
4zgx-A-601	`sad. +0.11 ruf. -0.38 dom. +0.21 bre. +0.08`	QHC	chainID: A, resSeq: 602, molecule: N-[(8R)-4-(4-chloro-3-fluorophenyl)-5,6,7,8-tetrahydroisoquinolin-8-yl]propanamide
4zgx-B-601	`sad. -0.07 ruf. -0.02 dom. +0.20 bre. -0.05`	CYS	chainID: B, resSeq: 450, molecule: Cytochrome P450 11B2, mitochondrial	oxidoreductase oligomeric count: 1 pocket vol.: 392.0 Å³ d(Fe-oop): 0.144 Å
4zgx-B-601	`sad. -0.07 ruf. -0.02 dom. +0.20 bre. -0.05`	QHC	chainID: B, resSeq: 602, molecule: N-[(8R)-4-(4-chloro-3-fluorophenyl)-5,6,7,8-tetrahydroisoquinolin-8-yl]propanamide
4zgx-C-601	`sad. +0.07 ruf. -0.13 dom. +0.19 bre. +0.11`	CYS	chainID: C, resSeq: 450, molecule: Cytochrome P450 11B2, mitochondrial	oxidoreductase oligomeric count: 1 pocket vol.: 406.0 Å³ d(Fe-oop): 0.068 Å
4zgx-C-601	`sad. +0.07 ruf. -0.13 dom. +0.19 bre. +0.11`	QHC	chainID: C, resSeq: 602, molecule: N-[(8R)-4-(4-chloro-3-fluorophenyl)-5,6,7,8-tetrahydroisoquinolin-8-yl]propanamide
4zgx-D-601	`sad. +0.13 ruf. -0.26 dom. +0.25 bre. +0.10`	CYS	chainID: D, resSeq: 450, molecule: Cytochrome P450 11B2, mitochondrial	oxidoreductase oligomeric count: 1 pocket vol.: 389.0 Å³ d(Fe-oop): 0.156 Å
4zgx-D-601	`sad. +0.13 ruf. -0.26 dom. +0.25 bre. +0.10`	QHC	chainID: D, resSeq: 602, molecule: N-[(8R)-4-(4-chloro-3-fluorophenyl)-5,6,7,8-tetrahydroisoquinolin-8-yl]propanamide
4zgx-E-601	`sad. -0.04 ruf. -0.01 dom. +0.15 bre. +0.22`	CYS	chainID: E, resSeq: 450, molecule: Cytochrome P450 11B2, mitochondrial	oxidoreductase oligomeric count: 1 pocket vol.: 417.0 Å³ d(Fe-oop): 0.136 Å
4zgx-E-601	`sad. -0.04 ruf. -0.01 dom. +0.15 bre. +0.22`	QHC	chainID: E, resSeq: 602, molecule: N-[(8R)-4-(4-chloro-3-fluorophenyl)-5,6,7,8-tetrahydroisoquinolin-8-yl]propanamide
4zgx-F-601	`sad. -0.01 ruf. -0.16 dom. +0.18 bre. +0.15`	CYS	chainID: F, resSeq: 450, molecule: Cytochrome P450 11B2, mitochondrial	oxidoreductase oligomeric count: 1 pocket vol.: 408.0 Å³ d(Fe-oop): 0.125 Å
4zgx-F-601	`sad. -0.01 ruf. -0.16 dom. +0.18 bre. +0.15`	QHC	chainID: F, resSeq: 602, molecule: N-[(8R)-4-(4-chloro-3-fluorophenyl)-5,6,7,8-tetrahydroisoquinolin-8-yl]propanamide
4zgx-G-601	`sad. +0.04 ruf. -0.29 dom. +0.36 bre. +0.24`	CYS	chainID: G, resSeq: 450, molecule: Cytochrome P450 11B2, mitochondrial	oxidoreductase oligomeric count: 1 pocket vol.: 419.0 Å³ d(Fe-oop): 0.244 Å
4zgx-G-601	`sad. +0.04 ruf. -0.29 dom. +0.36 bre. +0.24`	Not assigned.
4zgx-H-601	`sad. +0.14 ruf. -0.37 dom. +0.57 bre. +0.25`	Not assigned.		unclassified oligomeric count: 1 pocket vol.: 436.0 Å³ d(Fe-oop): 0.303 Å
4zgx-H-601	`sad. +0.14 ruf. -0.37 dom. +0.57 bre. +0.25`	Not assigned.
4zgx-I-601	`sad. -0.16 ruf. -0.41 dom. +0.29 bre. +0.10`	CYS	chainID: I, resSeq: 450, molecule: Cytochrome P450 11B2, mitochondrial	oxidoreductase oligomeric count: 1 pocket vol.: 437.0 Å³ d(Fe-oop): 0.190 Å
4zgx-I-601	`sad. -0.16 ruf. -0.41 dom. +0.29 bre. +0.10`	QHC	chainID: I, resSeq: 602, molecule: N-[(8R)-4-(4-chloro-3-fluorophenyl)-5,6,7,8-tetrahydroisoquinolin-8-yl]propanamide
4zgx-K-601	`sad. -0.39 ruf. +0.05 dom. +0.02 bre. +0.22`	CYS	chainID: K, resSeq: 450, molecule: Cytochrome P450 11B2, mitochondrial	oxidoreductase oligomeric count: 1 pocket vol.: 413.0 Å³ d(Fe-oop): 0.002 Å
4zgx-K-601	`sad. -0.39 ruf. +0.05 dom. +0.02 bre. +0.22`	QHC	chainID: K, resSeq: 602, molecule: N-[(8R)-4-(4-chloro-3-fluorophenyl)-5,6,7,8-tetrahydroisoquinolin-8-yl]propanamide
4zgx-L-601	`sad. -0.18 ruf. -0.50 dom. +0.23 bre. +0.14`	CYS	chainID: L, resSeq: 450, molecule: Cytochrome P450 11B2, mitochondrial	oxidoreductase oligomeric count: 1 pocket vol.: 441.0 Å³ d(Fe-oop): 0.156 Å
4zgx-L-601	`sad. -0.18 ruf. -0.50 dom. +0.23 bre. +0.14`	QHC	chainID: L, resSeq: 602, molecule: N-[(8R)-4-(4-chloro-3-fluorophenyl)-5,6,7,8-tetrahydroisoquinolin-8-yl]propanamide