Research workbench
Conjugative relaxase trwc in complex with orit DNA. metal- bound structure
Analyse Conjugative relaxase trwc in complex with orit DNA. metal- bound structure in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.
- PDB
- 1S6M
- Type
- protein + DNA
- Length
- 313 residues
- Chains
- 2
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- Molecule
- DNA (25-mer); Trwc
- UniProt
- Q47673
- Ligands
- NI
- Pockets
- 5 · best druggability 0.72
Structure
x-ray diffraction · 2 distinct chains · 39% helix, 21% strand (DSSP).
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| B | DNA (25-mer) | dna | 25 | — | — |
| A | Trwc | protein | 288 | 39% helix, 21% strand | Q47673 |
Ligands and binding sites
- NI · Nickel (II) ion · metal · chains A
Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.
Pockets
5 pockets found on a 1 Å grid, 2 with a druggability of 0.5 or more.
| Volume (ų) | Druggability | Buriedness | Lining residues | Inside | |
|---|---|---|---|---|---|
| 1 | 474 | 0.72 | 0.82 | 37 | empty |
| 2 | 102 | 0.54 | 0.84 | 21 | empty |
| 3 | 120 | 0.49 | 0.80 | 29 | empty |
| 4 | 62 | 0.32 | 0.77 | 12 | empty |
| 5 | 69 | 0.32 | 0.75 | 13 | empty |
Interfaces
1 interface between chains.
- B–A · 2277 Ų buried · 47 hydrogen bonds · protein-nucleic
Modifications
Observed in the structure: 4 modified (engineered).
Compared structures
- 1S6M · Conjugative Relaxase Trwc In Complex With Orit DNA. Metal-Bound Structure · the same entry in another collection · chain B against B, 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 Q47673
- Elsewhere: RCSB PDB 1S6M · PDBe 1S6M · UniProt Q47673
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