PDB ID: pdb_00003qu8
- Crystal structure of a human cytochrome P450 2B6 (Y226H/K262R) in complex with the inhibitor 4-(4-Nitrobenzyl)pyridine.
- Experimental method: X-RAY DIFFRACTION
- Resolution: 2.8 Å
- Deposition date: 2011-02-23
Number of assemblies: 6
| Structural data | modeled |
|---|---|
| Oligomeric count | 1 |
| label_asym_ids of protein | |
| label_asym_ids of heme | |
| label_asym_ids of the others |
H (3QU  3QU
), I (CM5 CM5
)
|
Each chain information
| auth_asym_id | A |
|---|---|
| Residue indices (Uniprot) | 28-492 (20-491) |
| Mutations (UniProt numbering) | |
| Missing residues | 138GLY-140ARG |
| Structural gaps | Exists |
| Uniprot ID | P20813 ￫UniprotKB |
| label_asym_ids of heme | G |
| Available structure | PDB and Modeled |
| RMSD of experimental residues after energy minimization | 0.13 Å |
| Structural data | modeled |
|---|---|
| Oligomeric count | 1 |
| label_asym_ids of protein | |
| label_asym_ids of heme | |
| label_asym_ids of the others |
K (3QU3QU
), L (CM5CM5
), M (CM5CM5
)
|
Each chain information
| auth_asym_id | B |
|---|---|
| Residue indices (Uniprot) | 28-492 (20-491) |
| Mutations (UniProt numbering) | |
| Missing residues | 135PHE-140ARG |
| Structural gaps | Exists |
| Uniprot ID | P20813 ￫UniprotKB |
| label_asym_ids of heme | J |
| Available structure | PDB and Modeled |
| RMSD of experimental residues after energy minimization | 0.12 Å |
| Structural data | modeled |
|---|---|
| Oligomeric count | 1 |
| label_asym_ids of protein | |
| label_asym_ids of heme | |
| label_asym_ids of the others |
O (3QU3QU
), P (CM5CM5
)
|
Each chain information
| auth_asym_id | C |
|---|---|
| Residue indices (Uniprot) | 28-492 (20-491) |
| Mutations (UniProt numbering) | |
| Missing residues | 135PHE-137MET:376SER-376SER |
| Structural gaps | Exists |
| Uniprot ID | P20813 ￫UniprotKB |
| label_asym_ids of heme | N |
| Available structure | PDB and Modeled |
| RMSD of experimental residues after energy minimization | 0.14 Å |
| Structural data | modeled |
|---|---|
| Oligomeric count | 1 |
| label_asym_ids of protein | |
| label_asym_ids of heme | |
| label_asym_ids of the others |
R (3QU3QU
), S (CM5CM5
), T (CM5CM5
)
|
Each chain information
| auth_asym_id | D |
|---|---|
| Residue indices (Uniprot) | 28-491 (20-491) |
| Mutations (UniProt numbering) | |
| Missing residues | 135PHE-140ARG |
| Structural gaps | Exists |
| Uniprot ID | P20813 ￫UniprotKB |
| label_asym_ids of heme | Q |
| Available structure | PDB and Modeled |
| RMSD of experimental residues after energy minimization | 0.13 Å |
| Structural data | modeled |
|---|---|
| Oligomeric count | 1 |
| label_asym_ids of protein | |
| label_asym_ids of heme | |
| label_asym_ids of the others |
V (3QU3QU
), W (CM5CM5
)
|
Each chain information
| auth_asym_id | E |
|---|---|
| Residue indices (Uniprot) | 28-492 (20-491) |
| Mutations (UniProt numbering) | |
| Missing residues | 135PHE-140ARG |
| Structural gaps | Exists |
| Uniprot ID | P20813 ￫UniprotKB |
| label_asym_ids of heme | U |
| Available structure | PDB and Modeled |
| RMSD of experimental residues after energy minimization | 0.14 Å |
| Structural data | modeled |
|---|---|
| Oligomeric count | 1 |
| label_asym_ids of protein | |
| label_asym_ids of heme | |
| label_asym_ids of the others |
Y (CM5CM5
)
|
Each chain information
| auth_asym_id | F |
|---|---|
| Residue indices (Uniprot) | 28-486 (20-491) |
| Mutations (UniProt numbering) | |
| Missing residues | 135PHE-140ARG |
| Structural gaps | Exists |
| Uniprot ID | P20813 ￫UniprotKB |
| label_asym_ids of heme | X |
| Available structure | PDB and Modeled |
| RMSD of experimental residues after energy minimization | 0.14 Å |