Research workbench
TPX2_MINI decorated gmpcpp-microtubule
Analyse TPX2_MINI decorated gmpcpp-microtubule in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.
- PDB
- 6BJC
- Type
- protein
- Length
- 5,204 residues
- Chains
- 14
- Method
- electron microscopy
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- Molecule
- Tubulin alpha-1B chain; Tubulin beta chain; Targeting protein for XKLP2
- UniProt
- Q2XVP4, P02554, Q9ULW0
- Ligands
- GTP, G2P, MG
- Pockets
- 20 · best druggability 0.84
Structure
electron microscopy · 3 distinct chains · 49% helix, 18% strand (DSSP).
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A, C, E, J, L, K | Tubulin alpha-1B chain | protein | 430 | 48% helix, 17% strand | Q2XVP4 |
| B, D, F, H, G, I | Tubulin beta chain | protein | 427 | 50% helix, 20% strand | P02554 |
| T, P | Targeting protein for XKLP2 | protein | 31 | 32% helix, 0% strand | Q9ULW0 |
Ligands and binding sites
- GTP · Guanosine-5'-triphosphate · ligand · 6 copies · chains A, H, C, I, E, G, F, J, D, L, B, K
- G2P · Phosphomethylphosphonic acid guanylate ester · ligand · 6 copies · chains A, B, C, D, E, F, H, G, I
- MG · Magnesium ion · metal · 12 copies · chains A, B, C, D, E, G, F, J, H, L, K, I
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 | 258 | 0.84 | 0.96 | 43 | GTP, MG |
| 2 | 273 | 0.84 | 0.95 | 44 | GTP, MG |
| 3 | 266 | 0.84 | 0.95 | 44 | GTP, MG |
| 4 | 263 | 0.84 | 0.95 | 42 | GTP, MG |
| 5 | 751 | 0.83 | 0.87 | 95 | G2P, MG |
Interfaces
25 interfaces between chains.
- A–H · 1943 Ų buried · 17 hydrogen bonds · protein-protein
- B–K · 1942 Ų buried · 17 hydrogen bonds · protein-protein
- E–G · 1934 Ų buried · 17 hydrogen bonds · protein-protein
- F–J · 1933 Ų buried · 17 hydrogen bonds · protein-protein
- C–I · 1930 Ų buried · 17 hydrogen bonds · protein-protein
Compared structures
- 6BJC · TPX2_mini decorated GMPCPP-microtubule · the same entry in another collection · chain P against P, 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 Q2XVP4
- Every structure of UniProt P02554
- Every structure of UniProt Q9ULW0
- Elsewhere: RCSB PDB 6BJC · PDBe 6BJC · UniProt Q2XVP4 · UniProt P02554 · UniProt Q9ULW0
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