Receptor
PDB id Resolution Class Description Source Keywords
4ZZ8 1.65 Å EC: 3.2.1.4 X-RAY CRYSTAL STRUCTURE OF CHITOSAN-BINDING MODULE 2 IN COMP CHITOTRIOSE DERIVED FROM CHITOSANASE/GLUCANASE FROM PAENIBAI K-5 PAENIBACILLUS FUKUINENSIS CHITOSAN CBM32 CHITOSANASE/GLUCANASE B-SANDWICH HYDROLAS
Ref.: MECHANISM OF CHITOSAN RECOGNITION BY CBM32 CARBOHYDRATE-BINDING MODULES FROM A PAENIBACILLUS S CHITOSANASE/GLUCANASE BIOCHEM.J. V. 473 1085 2016
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
EDO A:207;
A:205;
A:206;
 Invalid;
Invalid;
Invalid;
 none;
none;
none;
 submit data
62.068 C2 H6 O2 C(CO)...
SO4 A:201;
B:201;
A:203;
A:204;
A:202;
 Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
 none;
none;
none;
none;
none;
 submit data
96.063 O4 S [O-]S...
GCS GCS GCS C:1;
 Valid;
 none;
 submit data
472.512 n/a O(C1C...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
4ZZ8 1.65 Å EC: 3.2.1.4 X-RAY CRYSTAL STRUCTURE OF CHITOSAN-BINDING MODULE 2 IN COMP CHITOTRIOSE DERIVED FROM CHITOSANASE/GLUCANASE FROM PAENIBAI K-5 PAENIBACILLUS FUKUINENSIS CHITOSAN CBM32 CHITOSANASE/GLUCANASE B-SANDWICH HYDROLAS
Ref.: MECHANISM OF CHITOSAN RECOGNITION BY CBM32 CARBOHYDRATE-BINDING MODULES FROM A PAENIBACILLUS S CHITOSANASE/GLUCANASE BIOCHEM.J. V. 473 1085 2016
Members (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 46 families.
1 4ZZ8 - GCS GCS GCS n/a n/a
70% Homology Family (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 43 families.
1 4ZZ8 - GCS GCS GCS n/a n/a
50% Homology Family (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 32 families.
1 4ZZ8 - GCS GCS GCS n/a n/a
Polypharmacology
Similar Ligands (2D)
Ligand no: 1; Ligand: GCS GCS GCS; Similar ligands found: 5
No: Ligand ECFP6 Tc MDL keys Tc
1 GCS GCS GCS 1 1
2 GCS GCS GCS GCS GCS 0.723077 0.9375
3 GCS GCS GCS GCS GCS GCS GCS GCS 0.58209 0.914894
4 GCS GCS GCS GCS GCS GCS 0.58209 0.914894
5 GCS GCS 0.522388 0.914894
Similar Ligands (3D)
Ligand no: 1; Ligand: GCS GCS GCS; Similar ligands found: 13
No: Ligand Similarity coefficient
1 BGC BGC BGC 0.9773
2 GLC BGC BGC 0.9672
3 GLC SHD Z6H 0.9369
4 BMA BMA BGC 0.9304
5 BGC OXZ BGC 0.9276
6 G2I 0.9267
7 SGC SGC BGC 0.9229
8 BMA BMA BMA 0.9140
9 MAN BMA BMA 0.8986
10 GTM BGC BGC 0.8955
11 GCU MAV MAW 0.8884
12 GS1 GLC GS1 0.8881
13 XYP XYP XYP 0.8773
Similar Binding Sites (Proteins are less than 50% similar to leader) APoc FAQ
Feedback