Research workbench
BON1
Analyse BON1 in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.
- PDB
- 6KXU
- Type
- protein
- Length
- 4,290 residues
- Chains
- 8
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- Molecule
- Protein bonzai 1
- UniProt
- Q941L3
- Ligands
- MN, CL
- Pockets
- 20 · best druggability 0.77
Structure
x-ray diffraction · 6 distinct chains · 24% helix, 34% strand (DSSP).
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A | Protein bonzai 1 | protein | 546 | 24% helix, 34% strand | Q941L3 |
| B | Protein bonzai 1 | protein | 504 | 23% helix, 35% strand | Q941L3 |
| C, D, F | Protein bonzai 1 | protein | 553 | 24% helix, 33% strand | Q941L3 |
| E | Protein bonzai 1 | protein | 534 | 24% helix, 33% strand | Q941L3 |
| G | Protein bonzai 1 | protein | 504 | 23% helix, 35% strand | Q941L3 |
| H | Protein bonzai 1 | protein | 543 | 24% helix, 33% strand | Q941L3 |
Ligands and binding sites
- MN · Manganese (II) ion · metal · 10 copies · chains A, B, C, D, E, F, G, H
- CL · Chloride ion · ion · 2 copies · chains C, D
- EDO · 1,2-ethanediol · additive · 14 copies · chains A, B, C, E, D, F, G, H
- GOL · Glycerol · additive · chains A
Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.
Pockets
20 pockets found on a 1 Å grid, 20 with a druggability of 0.5 or more.
| Volume (ų) | Druggability | Buriedness | Lining residues | Inside | |
|---|---|---|---|---|---|
| 1 | 1114 | 0.77 | 0.79 | 88 | empty |
| 2 | 976 | 0.77 | 0.79 | 99 | EDO |
| 3 | 651 | 0.75 | 0.81 | 50 | EDO |
| 4 | 314 | 0.73 | 0.85 | 43 | empty |
| 5 | 514 | 0.70 | 0.80 | 53 | EDO |
Interfaces
12 interfaces between chains.
- D–G · 1098 Ų buried · 13 hydrogen bonds · protein-protein
- B–F · 1035 Ų buried · 15 hydrogen bonds · protein-protein
- B–D · 588 Ų buried · 4 hydrogen bonds · protein-protein
- C–E · 544 Ų buried · 5 hydrogen bonds · protein-protein
- E–F · 515 Ų buried · 5 hydrogen bonds · protein-protein
Compared structures
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 Q941L3
- Elsewhere: RCSB PDB 6KXU · PDBe 6KXU · UniProt Q941L3
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