PDB ID: pdb_00008fgm
- Structure of human neuronal nitric oxide synthase R354A/G357D mutant heme domain in complex with 4-(difluoromethyl)-6-(5-(2-(dimethylamino)ethyl)-2,3-difluorophenethyl)pyridin-2-amine
- Experimental method: X-RAY DIFFRACTION
- Resolution: 2.1 Å
- Deposition date: 2022-12-12
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 (H4B  H4B
), G (XVA XVA
), H (GOL GOL
), I (GOLGOL
), J (H4BH4B
), K (ZN ZN
), M (XVAXVA
), N (GOLGOL
)
|
Each chain information
| auth_asym_id | A |
|---|---|
| Residue indices (Uniprot) | 303-722 (302-722) |
| Mutations (UniProt numbering) | |
| Missing residues | 344SER-348ARG |
| Structural gaps | Exists |
| Uniprot ID | P29475 ￫UniprotKB |
| label_asym_ids of heme | E |
| Available structure | PDB and Modeled |
| RMSD of experimental residues after energy minimization | 0.09 Å |
| Structural data | modeled |
|---|---|
| Oligomeric count | 2 |
| label_asym_ids of protein | |
| label_asym_ids of heme | |
| label_asym_ids of the others |
P (H4BH4B
), Q (XVAXVA
), R (GOLGOL
), S (GOLGOL
), T (ZNZN
), V (H4BH4B
), W (XVAXVA
), X (GOLGOL
)
|
Each chain information
| auth_asym_id | C |
|---|---|
| Residue indices (Uniprot) | 303-722 (302-722) |
| Mutations (UniProt numbering) | |
| Uniprot ID | P29475 ￫UniprotKB |
| label_asym_ids of heme | O |
| Available structure | PDB |
| auth_asym_id | D |
|---|---|
| Residue indices (Uniprot) | 304-722 (302-722) |
| Mutations (UniProt numbering) | |
| Missing residues | 345GLN-349ARG |
| Structural gaps | Exists |
| Uniprot ID | P29475 ￫UniprotKB |
| label_asym_ids of heme | U |
| Available structure | PDB and Modeled |
| RMSD of experimental residues after energy minimization | 0.11 Å |