PDB ID: pdb_00008sg5
- Cytochrome P450 (CYP) 3A5 crystallized with clotrimazole
- Experimental method: X-RAY DIFFRACTION
- Resolution: 2.8 Å
- Deposition date: 2023-04-11
Number of assemblies: 8
| Structural data | modeled |
|---|---|
| Oligomeric count | 1 |
| label_asym_ids of protein | |
| label_asym_ids of heme | |
| label_asym_ids of the others |
J (CL6  CL6
), K (CL6CL6
), L (CL6CL6
), M (CE9 CE9
)
|
Each chain information
| auth_asym_id | A |
|---|---|
| Residue indices (Uniprot) | 23-496 (24-497) |
| Mutations (UniProt numbering) | |
| Missing residues | 260ARG-269LEU:280ASN-287HIS |
| Structural gaps | Exists |
| Uniprot ID | P20815 ￫UniprotKB |
| label_asym_ids of heme | I |
| 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 (CL6CL6
), P (CL6CL6
), Q (CL6CL6
), R (CE9CE9
)
|
Each chain information
| auth_asym_id | B |
|---|---|
| Residue indices (Uniprot) | 23-496 (24-497) |
| Mutations (UniProt numbering) | |
| Missing residues | 260ARG-269LEU:280ASN-287HIS |
| Structural gaps | Exists |
| Uniprot ID | P20815 ￫UniprotKB |
| label_asym_ids of heme | N |
| 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 |
T (CL6CL6
), U (CL6CL6
), V (CL6CL6
), W (CE9CE9
)
|
Each chain information
| auth_asym_id | C |
|---|---|
| Residue indices (Uniprot) | 27-495 (24-497) |
| Mutations (UniProt numbering) | |
| Missing residues | 260ARG-269LEU:280ASN-287HIS |
| Structural gaps | Exists |
| Uniprot ID | P20815 ￫UniprotKB |
| label_asym_ids of heme | S |
| 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 |
AA (CL6CL6
), BA (CE9CE9
), Y (CL6CL6
), Z (CL6CL6
)
|
Each chain information
| auth_asym_id | D |
|---|---|
| Residue indices (Uniprot) | 26-496 (24-497) |
| Mutations (UniProt numbering) | |
| Missing residues | 260ARG-269LEU:280ASN-287HIS |
| Structural gaps | Exists |
| Uniprot ID | P20815 ￫UniprotKB |
| label_asym_ids of heme | X |
| Available structure | PDB and Modeled |
| RMSD of experimental residues after energy minimization | 0.11 Å |
| Structural data | modeled |
|---|---|
| Oligomeric count | 1 |
| label_asym_ids of protein | |
| label_asym_ids of heme | |
| label_asym_ids of the others |
DA (CL6CL6
), EA (CL6CL6
), FA (CL6CL6
), GA (CE9CE9
)
|
Each chain information
| auth_asym_id | E |
|---|---|
| Residue indices (Uniprot) | 27-496 (24-497) |
| Mutations (UniProt numbering) | |
| Missing residues | 260ARG-269LEU:280ASN-287HIS |
| Structural gaps | Exists |
| Uniprot ID | P20815 ￫UniprotKB |
| label_asym_ids of heme | CA |
| 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 |
IA (CL6CL6
), JA (CL6CL6
), KA (CL6CL6
), LA (CE9CE9
)
|
Each chain information
| auth_asym_id | F |
|---|---|
| Residue indices (Uniprot) | 27-496 (24-497) |
| Mutations (UniProt numbering) | |
| Missing residues | 260ARG-269LEU:280ASN-287HIS |
| Structural gaps | Exists |
| Uniprot ID | P20815 ￫UniprotKB |
| label_asym_ids of heme | HA |
| 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 |
NA (CL6CL6
), OA (CL6CL6
), PA (CL6CL6
), QA (CE9CE9
)
|
Each chain information
| auth_asym_id | G |
|---|---|
| Residue indices (Uniprot) | 30-496 (24-497) |
| Mutations (UniProt numbering) | |
| Missing residues | 260ARG-269LEU:280ASN-287HIS |
| Structural gaps | Exists |
| Uniprot ID | P20815 ￫UniprotKB |
| label_asym_ids of heme | MA |
| 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 |
SA (CL6CL6
), TA (CL6CL6
), UA (CL6CL6
)
|
Each chain information
| auth_asym_id | H |
|---|---|
| Residue indices (Uniprot) | 26-496 (24-497) |
| Mutations (UniProt numbering) | |
| Missing residues | 260ARG-269LEU:280ASN-287HIS:419PHE-425SER |
| Structural gaps | Exists |
| Uniprot ID | P20815 ￫UniprotKB |
| label_asym_ids of heme | RA |
| Available structure | PDB and Modeled |
| RMSD of experimental residues after energy minimization | 0.12 Å |