MolNFT v1 · #42145 · protein
Solution NMR structure of HTH_XRE family transcriptional regulator BT_P548217 from bacteroides thetaiotaomicron. northeast structural genomics consortium target BTR244.
2K9Q · Uncharacterized protein: “Solution NMR structure of HTH_XRE family transcriptional regulator BT_P548217 from bacteroides…”. Solution nmr, 3 pockets (best druggability 0.67). MolNFT v1 #42145 on GenesisL1: 3D structure, binding sites…
- PDB
- 2K9Q
- Type
- protein
- Length
- 154 residues
- Chains
- 2
- Method
- solution nmr
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- Molecule
- Uncharacterized protein
- UniProt
- Q8ABY1
- Pockets
- 3 · best druggability 0.67
Structure
solution nmr · 1 distinct chain · 61% helix, 0% strand (DSSP).
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A, B | Uncharacterized protein | protein | 77 | 61% helix, 0% strand | Q8ABY1 |
Pockets
3 pockets found on a 1 Å grid, 2 with a druggability of 0.5 or more.
| Volume (ų) | Druggability | Buriedness | Lining residues | Inside | |
|---|---|---|---|---|---|
| 1 | 352 | 0.67 | 0.81 | 54 | empty |
| 2 | 67 | 0.59 | 0.89 | 19 | empty |
| 3 | 94 | 0.37 | 0.75 | 16 | empty |
Interfaces
1 interface between chains.
- A–B · 1605 Ų buried · 2 hydrogen bonds · protein-protein
Compared structures
- 2K9Q · Solution NMR structure of HTH_XRE family transcriptional regulator BT_p548217 from… · 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 Q8ABY1
- Elsewhere: RCSB PDB 2K9Q · PDBe 2K9Q · UniProt Q8ABY1
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