MolNFT v1 · #30557 · protein
Crystal structure of klebsiella pneumoniae protein orfy, pfam DUF336
2A2L · Unknown: “Crystal structure of klebsiella pneumoniae protein orfy, pfam DUF336”. X-ray diffraction, 5 pockets (best druggability 0.76). MolNFT v1 #30557 on GenesisL1: 3D structure, binding sites and pockets in GL1X.
- PDB
- 2A2L
- Type
- protein
- Length
- 576 residues
- Chains
- 4
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- Molecule
- Unknown
- UniProt
- Q48422
- Pockets
- 5 · best druggability 0.76
Structure
x-ray diffraction · 2 distinct chains · 40% helix, 23% strand (DSSP).
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A, B | Unknown | protein | 145 | 41% helix, 22% strand | Q48422 |
| C, D | Unknown | protein | 143 | 38% helix, 23% strand | Q48422 |
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 | 1050 | 0.76 | 0.79 | 99 | empty |
| 2 | 128 | 0.64 | 0.88 | 25 | empty |
| 3 | 82 | 0.48 | 0.82 | 21 | empty |
| 4 | 66 | 0.46 | 0.83 | 20 | empty |
| 5 | 72 | 0.39 | 0.79 | 16 | empty |
Interfaces
5 interfaces between chains.
- A–D · 1142 Ų buried · 27 hydrogen bonds · protein-protein
- B–C · 1109 Ų buried · 22 hydrogen bonds · protein-protein
- C–D · 801 Ų buried · 3 hydrogen bonds · protein-protein
- A–B · 795 Ų buried · 6 hydrogen bonds · protein-protein
- B–D · 692 Ų buried · 16 hydrogen bonds · protein-protein
Compared structures
- 2A2L · Crystal structure of Klebsiella pneumoniae protein ORFY, Pfam DUF336 · 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 Q48422
- Elsewhere: RCSB PDB 2A2L · PDBe 2A2L · UniProt Q48422
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