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Structural Analysis of a Nitrogenase Iron Protein from Methanosarcina acetivorans: Implications for CO2 Capture by a Surface-Exposed [Fe4S4] Cluster
Analyse Structural Analysis of a Nitrogenase Iron Protein from Methanosarcina… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.
- PDB
- 6NZJ
- Type
- protein
- Length
- 546 residues
- Chains
- 2
- Method
- x-ray diffraction
- Collection
- MolNFT v2 / PDB Bank
- Contract
- 0xd58B01f6C18086e5202cdC5D7Ad3E41790360102
- Owner
- 0xF4e1AA6f26B7DA48EeAD9B24a97927303eeA07b8
- Resolution
- 2.4
- Source
- Methanosarcina acetivorans (strain ATCC 35395 / DSM 2834 / JCM 12185 / C2A)
- Molecule
- Nitrogenase iron protein
- EC
- 1.18.6.1
- UniProt
- Q8TJ93
- Ligands
- SF4, SO4
- Pockets
- 4 · best druggability 0.79
Structure
x-ray diffraction · resolution 2.4 · 1 distinct chain · 41% helix, 16% strand (DSSP).
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A, B | Nitrogenase iron protein (EC 1.18.6.1) | protein | 273 | 41% helix, 16% strand | Q8TJ93 |
Ligands and binding sites
Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.
Pockets
4 pockets found on a 1 Å grid, 3 with a druggability of 0.5 or more.
| Volume (ų) | Druggability | Buriedness | Lining residues | Inside | |
|---|---|---|---|---|---|
| 1 | 1081 | 0.79 | 0.81 | 84 | SO4 |
| 2 | 217 | 0.68 | 0.85 | 44 | empty |
| 3 | 169 | 0.60 | 0.83 | 36 | empty |
| 4 | 71 | 0.42 | 0.80 | 22 | SF4 |
Interfaces
1 interface between chains.
- A–B · 1773 Ų buried · 14 hydrogen bonds · protein-protein
Compared structures
- 6NZJ · Structural analysis of a nitrogenase iron protein from methanosarcina acetivorans… · the same entry in another collection · chain A against A, TM-score 1.00
Analyse
- Open in the research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides and crosslinks on the 3D structure
- Every structure of UniProt Q8TJ93
- Elsewhere: RCSB PDB 6NZJ · PDBe 6NZJ · UniProt Q8TJ93
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