PDB ID: pdb_00009c1z
- Structure of human endothelial nitric oxide synthase heme domain in complex with 7-((3-(((4-(6-aminopyridin-2-yl)butyl)amino)methyl)phenoxy)methyl)quinolin-2-amine
- Experimental method: X-RAY DIFFRACTION
- Resolution: 2 Å
- Deposition date: 2024-05-30
Number of assemblies: 2
| Structural data | modeled |
|---|---|
| Oligomeric count | 2 |
| label_asym_ids of protein | |
| label_asym_ids of heme | |
| label_asym_ids of the others |
F (V5D  V5D
), G (BTB BTB
), H (BTBBTB
), I (BTBBTB
), J (GOL GOL
), K (GOLGOL
), L (CL CL
), M (GD GD
), N (ZN ZN
), O (GOLGOL
), Q (V5DV5D
), R (BTBBTB
), S (BTBBTB
), T (CLCL
), U (GDGD
), V (BTBBTB
), W (GDGD
)
|
Each chain information
| auth_asym_id | A |
|---|---|
| Residue indices (Uniprot) | 67-480 (41-480) |
| Mutations (UniProt numbering) | |
| Missing residues | 107ARG-119ALA |
| Structural gaps | Exists |
| Uniprot ID | P29474 ￫UniprotKB |
| label_asym_ids of heme | E |
| Available structure | PDB and Modeled |
| RMSD of experimental residues after energy minimization | 0.12 Å |
| auth_asym_id | B |
|---|---|
| Residue indices (Uniprot) | 68-480 (41-480) |
| Mutations (UniProt numbering) | |
| Missing residues | 107ARG-118PRO |
| Structural gaps | Exists |
| Uniprot ID | P29474 ￫UniprotKB |
| label_asym_ids of heme | P |
| Available structure | PDB and Modeled |
| RMSD of experimental residues after energy minimization | 0.10 Å |
| Structural data | modeled |
|---|---|
| Oligomeric count | 2 |
| label_asym_ids of protein | |
| label_asym_ids of heme | |
| label_asym_ids of the others |
AA (BTBBTB
), BA (GOLGOL
), CA (GOLGOL
), DA (CLCL
), EA (ZNZN
), GA (V5DV5D
), HA (BTBBTB
), IA (BTBBTB
), JA (CLCL
), KA (GDGD
), Y (V5DV5D
), Z (BTBBTB
)
|
Each chain information
| auth_asym_id | C |
|---|---|
| Residue indices (Uniprot) | 67-480 (41-480) |
| Mutations (UniProt numbering) | |
| Missing residues | 107ARG-118PRO |
| Structural gaps | Exists |
| Uniprot ID | P29474 ￫UniprotKB |
| label_asym_ids of heme | X |
| Available structure | PDB and Modeled |
| RMSD of experimental residues after energy minimization | 0.10 Å |
| auth_asym_id | D |
|---|---|
| Residue indices (Uniprot) | 68-480 (41-480) |
| Mutations (UniProt numbering) | |
| Missing residues | 108LYS-118PRO |
| Structural gaps | Exists |
| Uniprot ID | P29474 ￫UniprotKB |
| label_asym_ids of heme | FA |
| Available structure | PDB and Modeled |
| RMSD of experimental residues after energy minimization | 0.10 Å |