Receptor
PDB id Resolution Class Description Source Keywords
2X2T 1.97 Å NON-ENZYME: OTHER CRYSTAL STRUCTURE OF SCLEROTINIA SCLEROTIORUM AGGLUTININ SSA COMPLEX WITH GAL-BETA1,3-GALNAC SCLEROTINIA SCLEROTIORUM FUNGAL LECTIN BETA-TREFOIL DOMAIN CELL ADHESION
Ref.: CRYSTAL STRUCTURE OF THE GALNAC/GAL-SPECIFIC AGGLUT THE PHYTOPATHOGENIC ASCOMYCETE SCLEROTINIA SCLEROTI REVEALS NOVEL ADAPTATION OF A BETA-TREFOIL DOMAIN J.MOL.BIOL. V. 400 715 2010
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
PG4 A:1159;
A:1160;
Invalid;
Invalid;
none;
none;
submit data
194.226 C8 H18 O5 C(COC...
SO4 A:1155;
A:1156;
A:1157;
A:1158;
Invalid;
Invalid;
Invalid;
Invalid;
none;
none;
none;
none;
submit data
96.063 O4 S [O-]S...
NGA GAL B:1;
Valid;
none;
submit data
n/a n/a
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
2X2T 1.97 Å NON-ENZYME: OTHER CRYSTAL STRUCTURE OF SCLEROTINIA SCLEROTIORUM AGGLUTININ SSA COMPLEX WITH GAL-BETA1,3-GALNAC SCLEROTINIA SCLEROTIORUM FUNGAL LECTIN BETA-TREFOIL DOMAIN CELL ADHESION
Ref.: CRYSTAL STRUCTURE OF THE GALNAC/GAL-SPECIFIC AGGLUT THE PHYTOPATHOGENIC ASCOMYCETE SCLEROTINIA SCLEROTI REVEALS NOVEL ADAPTATION OF A BETA-TREFOIL DOMAIN J.MOL.BIOL. V. 400 715 2010
Members (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1610 families.
1 2X2T - NGA GAL 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 1331 families.
1 2X2T - NGA GAL 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 1144 families.
1 2X2T - NGA GAL n/a n/a
Polypharmacology
Similar Ligands (2D)
Ligand no: 1; Ligand: NGA GAL; Similar ligands found: 0
No: Ligand ECFP6 Tc MDL keys Tc
Similar Ligands (3D)
Ligand no: 1; Ligand: NGA GAL; Similar ligands found: 33
No: Ligand Similarity coefficient
1 NGA GAL 1.0000
2 A2G GAL 0.9798
3 MGC GAL 0.9539
4 NOK GAL 0.9463
5 GAL NOK 0.9463
6 NAG GAL 0.9460
7 NGA GCD 0.9412
8 LOG GAL 0.9410
9 NAG GAD 0.9259
10 NAG GCD 0.9259
11 NAG GC4 0.9197
12 NDG GAD 0.9187
13 NAG BDP 0.9133
14 BGC GAL 0.8996
15 GAL NGT 0.8989
16 NGT GAL 0.8989
17 MBG GAL 0.8960
18 GLC GAL 0.8910
19 GAL GLA 0.8845
20 GAL GAL 0.8844
21 NDG GAL 0.8805
22 NGA NAG 0.8800
23 FRU GAL 0.8776
24 BGC BGC 0.8747
25 NOY BGC 0.8729
26 BMA GAL 0.8712
27 IFM BMA 0.8660
28 PA1 GCS 0.8651
29 4WS GAL 0.8600
30 BMA BMA 0.8588
31 YIO GAL 0.8576
32 NG6 GCD 0.8531
33 GAL NAG 0.8512
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 2X2T; Ligand: NGA GAL; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 1) in the query (biounit: 2x2t.bio1) has 9 residues
No: Leader PDB Ligand Sequence Similarity
APoc FAQ
Feedback