MolNFT v1 · #142810 · protein

Crystal structure of maltose O-acetyltransferase from E. COLI

6AG8: “Crystal structure of maltose O-acetyltransferase from E. COLI”. X-ray diffraction, 1 pocket (best druggability 0.56). MolNFT v1 #142810 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB: 6AG8
Type: protein
Length: 364 residues
Chains: 2
Method: x-ray diffraction
Collection: MolNFT v1 / PDB
Contract: 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner: 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule: Maltose O-acetyltransferase
EC: 2.3.1.79
UniProt: P77791
Pockets: 1 · best druggability 0.56

Structure

x-ray diffraction · 1 distinct chain · 23% helix, 32% strand (DSSP).

Chain	Molecule	Type	Residues	Secondary structure	UniProt
C, A	Maltose O-acetyltransferase (EC 2.3.1.79)	protein	182	23% helix, 32% strand	P77791

Ligands and binding sites

TRS · 2-amino-2-hydroxymethyl-propane-1,3-diol · additive · 2 copies · chains C, A

Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.

Pockets

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

Pocket	Volume (Å³)	Druggability	Buriedness	Lining residues	Inside
1	304	0.56	0.76	41	empty

Interfaces

1 interface between chains.

C–A · 160 Å² buried · 1 hydrogen bond · protein-protein

Compared structures

6AG8 · Crystal structure of Maltose O-acetyltransferase from E. coli · the same entry in another collection · chain C against C, TM-score 1.00
P77791 · AlphaFold monomer V2.0 prediction for maltose O-acetyltransferase (P77791) · a predicted model of the same protein · chain C against A, TM-score 0.99

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 P77791
Elsewhere: RCSB PDB 6AG8 · PDBe 6AG8 · UniProt P77791

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