MolNFT v1 · #174088 · protein

Crystal structure of wt BA3943, a CE4 family pseudoenzyme from bacillus anthracis

7BKF · Putative polysaccharide deacetylase: “Crystal structure of wt BA3943, a CE4 family pseudoenzyme from bacillus anthracis”. X-ray diffraction, 1 ligand (SO4), 3 pockets (best druggability 0.49). MolNFT v1 #174088 on GenesisL1: 3D…

PDB: 7BKF
Type: protein
Length: 281 residues
Chains: 1
Method: x-ray diffraction
Collection: MolNFT v1 / PDB
Contract: 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner: 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule: Putative polysaccharide deacetylase
UniProt: A0A6H3AKM9
Ligands: SO4
Pockets: 3 · best druggability 0.49

Structure

x-ray diffraction · 1 distinct chain · 44% helix, 18% strand (DSSP).

Chain	Molecule	Type	Residues	Secondary structure	UniProt
A	Putative polysaccharide deacetylase	protein	281	44% helix, 18% strand	A0A6H3AKM9

Ligands and binding sites

SO4 · Sulfate ion · ion · 4 copies · chains A
TRS · 2-amino-2-hydroxymethyl-propane-1,3-diol · additive · chains A

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

Pockets

3 pockets found on a 1 Å grid, 0 with a druggability of 0.5 or more.

Pocket	Volume (Å³)	Druggability	Buriedness	Lining residues	Inside
1	117	0.49	0.80	18	TRS
2	51	0.31	0.77	17	SO4
3	62	0.30	0.75	15	empty

Compared structures

7BKF · Crystal structure of WT BA3943, a CE4 family pseudoenzyme from Bacillus Anthracis · the same entry in another collection · chain A against A, 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 A0A6H3AKM9
Elsewhere: RCSB PDB 7BKF · PDBe 7BKF · UniProt A0A6H3AKM9

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