MolNFT v1 · #112794 · protein
Crystal structure of the mouse voltage gated calcium channel beta subunit isoform 1A in complex with alpha interaction domain peptide.
4ZW2 · Voltage-dependent L-type calcium channel subunit beta-1…: “Crystal structure of the mouse voltage gated calcium channel beta subunit isoform 1A in complex with alpha…”. X-ray diffraction, 2 ligands (ACE, NH2), 4 pockets (best…
- PDB
- 4ZW2
- Type
- protein
- Length
- 337 residues
- Chains
- 2
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- Molecule
- Voltage-dependent L-type calcium channel subunit beta-1, voltage-dependent L-type calcium…
- UniProt
- Q8R3Z5, Q02789
- Ligands
- ACE, NH2
- Pockets
- 4 · best druggability 0.48
Structure
x-ray diffraction · 2 distinct chains · 45% helix, 16% strand (DSSP).
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A | Voltage-dependent L-type calcium channel subunit beta-1, voltage-dependent L-type calcium channel subunit beta-1 | protein | 319 | 42% helix, 17% strand | Q8R3Z5 |
| B | Voltage-dependent L-type calcium channel subunit alpha-1S | protein | 18 | 83% helix, 0% strand | Q02789 |
Ligands and binding sites
- ACE · Acetyl group · ligand · chains B
- NH2 · Amino group · ion · chains A, B
- PGE · Triethylene glycol · additive · 2 copies · chains A
Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.
Pockets
4 pockets found on a 1 Å grid, 0 with a druggability of 0.5 or more.
| Volume (ų) | Druggability | Buriedness | Lining residues | Inside | |
|---|---|---|---|---|---|
| 1 | 170 | 0.48 | 0.76 | 38 | empty |
| 2 | 58 | 0.32 | 0.77 | 15 | empty |
| 3 | 52 | 0.32 | 0.77 | 15 | empty |
| 4 | 61 | 0.31 | 0.75 | 14 | empty |
Interfaces
1 interface between chains.
- A–B · 833 Ų buried · 5 hydrogen bonds · protein-protein
Modifications
Observed in the structure: 1 covalent (covalent ligand).
Compared structures
- 4ZW2 · Crystal structure of the Mouse voltage gated calcium channel beta subunit isoform 1a in… · the same entry in another collection · chain A against A, TM-score 1.00
- Q8R3Z5 · AlphaFold monomer V2.0 prediction for voltage-dependent L-type calcium channel subunit… · a predicted model of the same protein · chain A against A, TM-score 0.97
- Q02789 · AlphaFold monomer V2.0 prediction for voltage-dependent L-type calcium channel subunit… · a predicted model of the same protein · chain B against A, TM-score 0.81
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 Q8R3Z5
- Every structure of UniProt Q02789
- Elsewhere: RCSB PDB 4ZW2 · PDBe 4ZW2 · UniProt Q8R3Z5 · UniProt Q02789
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