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Receptor
PDB id Resolution Class Description Source Keywords
2INV 1.8 Å EC: 4.2.2.18 CRYSTAL STRUCTURE OF INSULIN FRUCTOTRANSFERASE IN THE PRESEN FRUCTOSE BACILLUS SP. SNU-7 RIGHT-HANDED PARALLEL BETA-HELIX PROTEIN-CARBOHYDRATE COMPL
Ref.: STRUCTURAL AND FUNCTIONAL INSIGHTS INTO INTRAMOLECU FRUCTOSYL TRANSFER BY INSULIN FRUCTOTRANSFERASE J.BIOL.CHEM. V. 282 8414 2007
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
2PO A:1002;
B:1001;
Invalid;
Invalid;
none;
none;
submit data
79.98 H O3 P [O-]P...
FRU FRU A:1;
B:1;
C:1;
Valid;
Valid;
Valid;
none;
none;
none;
submit data
342.297 n/a O(CC1...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
2INV 1.8 Å EC: 4.2.2.18 CRYSTAL STRUCTURE OF INSULIN FRUCTOTRANSFERASE IN THE PRESEN FRUCTOSE BACILLUS SP. SNU-7 RIGHT-HANDED PARALLEL BETA-HELIX PROTEIN-CARBOHYDRATE COMPL
Ref.: STRUCTURAL AND FUNCTIONAL INSIGHTS INTO INTRAMOLECU FRUCTOSYL TRANSFER BY INSULIN FRUCTOTRANSFERASE J.BIOL.CHEM. V. 282 8414 2007
Members (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1 families.
1 2INV - FRU FRU 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 1 families.
1 2INV - FRU FRU 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 1 families.
1 2INV - FRU FRU n/a n/a
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: FRU FRU; Similar ligands found: 10
No: Ligand ECFP6 Tc MDL keys Tc
1 FRU FRU 1 1
2 LBS 1 1
3 0UB 0.934783 1
4 SF6 0.511111 0.888889
5 FRU 0.511111 0.888889
6 SF9 0.511111 0.888889
7 PSV 0.511111 0.888889
8 LFR 0.511111 0.888889
9 TA6 0.490566 0.755556
10 F6P 0.490566 0.755556
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 2INV; Ligand: FRU FRU; Similar sites found with APoc: 24
This union binding pocket(no: 1) in the query (biounit: 2inv.bio1) has 13 residues
No: Leader PDB Ligand Sequence Similarity
1 5GXU FMN 1.70732
2 2IGA XX3 1.91781
3 5FFF 5XC 1.94553
4 3NTA FAD 1.95122
5 1VJ7 GDP 2.03562
6 4A0S NAP 2.43902
7 6C4M NAP 2.92683
8 1V08 NTZ 3.17073
9 4JBI NDP 3.24324
10 2X1E X1E 3.64146
11 6ESN BWE 4.49438
12 3VV1 GAL FUC 5.625
13 3POT TXZ 6.0241
14 3POT COM 6.0241
15 3POT TP7 6.0241
16 1XPM CAA 6.06061
17 5A8R TP7 6.58537
18 1B1C FMN 6.62983
19 5EXE 5SR 8.59873
20 2GTE VA 8.87097
21 5L0S UDP 9.52381
22 4GQB 0XU 15.9884
23 5L0U 660 21.4286
24 5L0R UDP 26.1905
Pocket No.: 2; Query (leader) PDB : 2INV; Ligand: FRU FRU; Similar sites found with APoc: 3
This union binding pocket(no: 2) in the query (biounit: 2inv.bio1) has 13 residues
No: Leader PDB Ligand Sequence Similarity
1 5WYZ 7VF 2.43902
2 1GQG DCD 3.71429
3 1DQX BMP 8.61423
Pocket No.: 3; Query (leader) PDB : 2INV; Ligand: FRU FRU; Similar sites found with APoc: 5
This union binding pocket(no: 3) in the query (biounit: 2inv.bio1) has 13 residues
No: Leader PDB Ligand Sequence Similarity
1 3RJ5 NAD 2.3622
2 5IKH 6BW 3.65854
3 3RUV ANP 3.65854
4 5IQT 6CU 11.4286
5 5IQT AKG 11.4286
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