Receptor
PDB id Resolution Class Description Source Keywords
2C3H 2.24 Å EC: 3.-.-.- STRUCTURE OF CBM26 FROM BACILLUS HALODURANS AMYLASE IN COMPLEX WITH MALTOSE BACILLUS HALODURANS CARBOHYDRATE-BINDING MODULE STARCH BINDING CARBOHYDRATE BINDING GLYCOSIDE HYDROLASE AMYLOSE AMYLOPECTIN MALTO-OLIGOSACCHARIDE CARBOHYDRATE- BINDING MODULE
Ref.: A STRUCTURAL AND FUNCTIONAL ANALYSIS OF ALPHA-GLUCAN RECOGNITION BY FAMILY 25 AND 26 CARBOHYDRATE-BINDING MODULES REVEALS A CONSERVED MODE OF STARCH RECOGNITION J.BIOL.CHEM. V. 281 587 2006
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
GLC D:300;
Invalid;
none;
submit data
180.156 C6 H12 O6 C([C@...
GLC GLC A:201;
B:201;
C:201;
D:201;
E:201;
F:201;
G:201;
H:201;
Valid;
Valid;
Valid;
Valid;
Valid;
Valid;
Valid;
Valid;
none;
none;
none;
none;
none;
none;
none;
none;
submit data
358.296 n/a O1C(O...
SO4 A:1097;
A:1098;
A:1099;
A:1100;
C:1096;
C:1097;
F:1096;
G:1097;
G:1098;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
none;
none;
none;
none;
none;
none;
none;
none;
none;
submit data
96.063 O4 S [O-]S...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
2C3H 2.24 Å EC: 3.-.-.- STRUCTURE OF CBM26 FROM BACILLUS HALODURANS AMYLASE IN COMPLEX WITH MALTOSE BACILLUS HALODURANS CARBOHYDRATE-BINDING MODULE STARCH BINDING CARBOHYDRATE BINDING GLYCOSIDE HYDROLASE AMYLOSE AMYLOPECTIN MALTO-OLIGOSACCHARIDE CARBOHYDRATE- BINDING MODULE
Ref.: A STRUCTURAL AND FUNCTIONAL ANALYSIS OF ALPHA-GLUCAN RECOGNITION BY FAMILY 25 AND 26 CARBOHYDRATE-BINDING MODULES REVEALS A CONSERVED MODE OF STARCH RECOGNITION J.BIOL.CHEM. V. 281 587 2006
Members (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 218 families.
1 2C3H - GLC GLC 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 176 families.
1 2C3H - GLC GLC 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 143 families.
1 2C3H - GLC GLC n/a n/a
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: GLC GLC; Similar ligands found: 7
No: Ligand ECFP6 Tc MDL keys Tc
1 GLC GLC 1 1
2 BGP 0.423077 0.707317
3 M6D 0.423077 0.707317
4 A6P 0.423077 0.707317
5 BG6 0.423077 0.707317
6 M6P 0.423077 0.707317
7 G6P 0.423077 0.707317
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 2C3H; Ligand: GLC GLC; Similar sites found: 18
This union binding pocket(no: 1) in the query (biounit: 2c3h.bio8) has 10 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 1NJF AGS 0.01334 0.42083 None
2 3R96 AMP 0.02263 0.40429 3.06122
3 3R96 ACO 0.02263 0.40429 3.06122
4 5UIU 8CG 0.01949 0.41441 4.08163
5 2J44 GLC GLC GLC 0.0007991 0.41223 5.10204
6 4I42 1HA 0.04941 0.40314 5.10204
7 1SQA UI1 0.04503 0.41177 6.12245
8 2VNO GAL GAL FUC 0.01786 0.40214 6.12245
9 1PVS 7HP 0.0009898 0.47172 7.14286
10 3NC9 TR3 0.02483 0.42725 7.14286
11 3BXF 13P 0.008848 0.41576 7.14286
12 1UKZ ADP 0.04574 0.40561 7.14286
13 3G5S GSH 0.0006043 0.40385 7.14286
14 3VC3 C6P 0.03147 0.40005 7.14286
15 1S8G DAO 0.01083 0.40199 8.16327
16 1PS9 NAP 0.007279 0.44415 12.2449
17 3TKY SAH 0.009001 0.42265 12.2449
18 1X9D SMD 0.01699 0.4044 20.4082
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