MolNFT v1 · #30857 · protein

The crystal structure of alpha-bungarotoxin at 2.5 ångströms resolution. relation to solution structure and binding to acetylcholine receptor

2ABX: “The crystal structure of alpha-bungarotoxin at 2.5 ångströms resolution. relation to solution structure and…”. X-ray diffraction, 2 pockets (best druggability 0.55). MolNFT v1 #30857 on GenesisL1: 3D structure, binding sites and…

PDB: 2ABX
Type: protein
Length: 148 residues
Chains: 2
Method: x-ray diffraction
Collection: MolNFT v1 / PDB
Contract: 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner: 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule: Alpha-bungarotoxin
UniProt: P60615
Pockets: 2 · best druggability 0.55

Structure

x-ray diffraction · 1 distinct chain · 0% helix, 5% strand (DSSP).

Chain	Molecule	Type	Residues	Secondary structure	UniProt
A, B	Alpha-bungarotoxin	protein	74	0% helix, 5% strand	P60615

Pockets

2 pockets found on a 1 Å grid, 1 with a druggability of 0.5 or more.

Pocket	Volume (Å³)	Druggability	Buriedness	Lining residues	Inside
1	109	0.55	0.84	30	empty
2	97	0.35	0.74	18	empty

Interfaces

1 interface between chains.

A–B · 386 Å² buried · 4 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 10 disulfide (disulfide).

Compared structures

2ABX · The crystal structure of alpha-bungarotoxin at 2.5 ångströms resolution. relation to… · the same entry in another collection · chain A against A, TM-score 1.00
P60615 · AlphaFold monomer V2.0 prediction for alpha-bungarotoxin (P60615) · a predicted model of the same protein · chain B against A, TM-score 0.62

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 P60615
Elsewhere: RCSB PDB 2ABX · PDBe 2ABX · UniProt P60615

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