Receptor
PDB id Resolution Class Description Source Keywords
1OFZ 1.5 Å NON-ENZYME: BINDING CRYSTAL STRUCTURE OF FUNGAL LECTIN: SIX-BLADED BETA-PROPELLER FOLD AND NOVEL FUCOSE RECOGNITION MODE FOR A LEURIA AURANTIA LECTIN ALEURIA AURANTIA SUGAR-BINDING PROTEIN LECTIN AAL FUCOSE ALEURIA AURANTIA LECTIN
Ref.: CRYSTAL STRUCTURE OF FUNGAL LECTIN: SIX-BLADED {BETA}-PROPELLER FOLD AND NOVEL FUCOSE RECOGNITION MODE FOR ALEURIA AURANTIA LECTIN J.BIOL.CHEM. V. 278 27059 2003
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
FUC A:1316;
A:1318;
B:1314;
B:1316;
Valid;
Valid;
Valid;
Valid;
none;
none;
none;
none;
submit data
164.156 C6 H12 O5 C[C@H...
FUL A:1313;
A:1314;
A:1315;
A:1317;
B:1313;
B:1315;
B:1317;
B:1318;
Valid;
Valid;
Valid;
Valid;
Valid;
Valid;
Valid;
Valid;
none;
none;
none;
none;
none;
none;
none;
none;
Kd = 24.1 uM
164.156 C6 H12 O5 C[C@H...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
1OFZ 1.5 Å NON-ENZYME: BINDING CRYSTAL STRUCTURE OF FUNGAL LECTIN: SIX-BLADED BETA-PROPELLER FOLD AND NOVEL FUCOSE RECOGNITION MODE FOR A LEURIA AURANTIA LECTIN ALEURIA AURANTIA SUGAR-BINDING PROTEIN LECTIN AAL FUCOSE ALEURIA AURANTIA LECTIN
Ref.: CRYSTAL STRUCTURE OF FUNGAL LECTIN: SIX-BLADED {BETA}-PROPELLER FOLD AND NOVEL FUCOSE RECOGNITION MODE FOR ALEURIA AURANTIA LECTIN J.BIOL.CHEM. V. 278 27059 2003
Members (3)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 473 families.
1 1OFZ Kd = 24.1 uM FUL C6 H12 O5 C[C@H]1[C@....
2 1IUC - FUL C6 H12 O5 C[C@H]1[C@....
3 1IUB - FUL C6 H12 O5 C[C@H]1[C@....
70% Homology Family (3)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 355 families.
1 1OFZ Kd = 24.1 uM FUL C6 H12 O5 C[C@H]1[C@....
2 1IUC - FUL C6 H12 O5 C[C@H]1[C@....
3 1IUB - FUL C6 H12 O5 C[C@H]1[C@....
50% Homology Family (8)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 272 families.
1 4D4U Kd = 91.9 uM FUC C6 H12 O5 C[C@H]1[C@....
2 4AGI - SFU C7 H14 O4 Se C[C@H]1[C@....
3 5EO8 - TFU C7 H14 O4 Se C[C@H]1[C@....
4 5H47 - FSW C8 H16 O4 Se C[C@H]1[C@....
5 5EO7 - SFU C7 H14 O4 Se C[C@H]1[C@....
6 1OFZ Kd = 24.1 uM FUL C6 H12 O5 C[C@H]1[C@....
7 1IUC - FUL C6 H12 O5 C[C@H]1[C@....
8 1IUB - FUL C6 H12 O5 C[C@H]1[C@....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: FUC; Similar ligands found: 9
No: Ligand ECFP6 Tc MDL keys Tc
1 G6D 1 1
2 XXR 1 1
3 FUL 1 1
4 FUC 1 1
5 RAM 1 1
6 FCA 1 1
7 RM4 1 1
8 FCB 1 1
9 FUF 0.424242 0.846154
Ligand no: 2; Ligand: FUL; Similar ligands found: 9
No: Ligand ECFP6 Tc MDL keys Tc
1 G6D 1 1
2 XXR 1 1
3 FUL 1 1
4 FUC 1 1
5 RAM 1 1
6 FCA 1 1
7 RM4 1 1
8 FCB 1 1
9 FUF 0.424242 0.846154
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 1OFZ; Ligand: FUL; Similar sites found: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 1) in the query (biounit: 1ofz.bio1) has 9 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
Pocket No.: 2; Query (leader) PDB : 1OFZ; Ligand: FUL; Similar sites found: 14
This union binding pocket(no: 2) in the query (biounit: 1ofz.bio1) has 12 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 2PA4 UPG 0.03211 0.40828 1.60256
2 3NW7 LGV 0.03092 0.42014 1.9544
3 1XG4 ICT 0.007059 0.43227 2.0339
4 4OUE IPT 0.00762 0.40972 2.24359
5 2JIG PD2 0.003394 0.40116 3.125
6 4J25 OGA 0.002545 0.4213 3.93013
7 4XB2 NDP 0.01375 0.42431 4.16667
8 5BV3 M7G 0.004279 0.44292 4.48718
9 1OJ7 NZQ 0.02272 0.41924 4.48718
10 5I8T LAC 0.001325 0.42553 5.58659
11 2HZQ STR 0.003727 0.41519 6.32184
12 3VC3 C6P 0.04392 0.40003 7.55814
13 4B1M FRU FRU 0.007185 0.41009 7.56757
14 5HV0 AKG 0.005164 0.4319 8.75576
Pocket No.: 3; Query (leader) PDB : 1OFZ; Ligand: FUL; Similar sites found: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 3) in the query (biounit: 1ofz.bio1) has 8 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
Pocket No.: 4; Query (leader) PDB : 1OFZ; Ligand: FUC; Similar sites found: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 4) in the query (biounit: 1ofz.bio1) has 12 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
Pocket No.: 5; Query (leader) PDB : 1OFZ; Ligand: FUC; Similar sites found: 40
This union binding pocket(no: 5) in the query (biounit: 1ofz.bio1) has 13 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 5I2E 67D 0.04528 0.41553 None
2 5A6N U7E 0.01498 0.4136 1.41343
3 3NW7 LGV 0.01914 0.43566 1.9544
4 1XG4 ICT 0.007463 0.42981 2.0339
5 4OUE IPT 0.004203 0.40145 2.24359
6 5CUQ NSC 0.04354 0.40695 2.24719
7 4NS0 PIO 0.004035 0.44027 2.25564
8 4B5W PYR 0.04163 0.40818 2.73438
9 4FFG LBS 0.004564 0.41832 2.88462
10 3WXL ADP 0.008465 0.41275 2.88462
11 3C6K SPD 0.02291 0.4257 3.20513
12 3C6K MTA 0.02291 0.4257 3.20513
13 3SVJ 4LI 0.009018 0.43054 3.44828
14 2JEN GLC GLC BGC XYS BGC XYS 0.02331 0.40762 3.44828
15 2X4Z X4Z 0.01397 0.432 3.71622
16 4TO8 FLC 0.001804 0.44525 3.76712
17 4XCB AKG 0.002306 0.42699 3.83142
18 1PZ1 NAP 0.02356 0.41405 4.16667
19 3GZ8 APR 0.01503 0.41633 4.32099
20 3M3E GAL A2G NPO 0.002802 0.40829 4.34783
21 5BV3 M7G 0.0207 0.40603 4.48718
22 3KP6 SAL 0.008419 0.40544 4.63576
23 4P7X AKG 0.001979 0.45658 4.79452
24 3ZOK NAD 0.0409 0.40596 5.12821
25 5I8T LAC 0.006395 0.40586 5.58659
26 3N8K D1X 0.004049 0.40084 5.81395
27 2HZQ STR 0.0002871 0.48033 6.32184
28 3MTX PGT 0.01037 0.43885 6.62252
29 4Q0L V14 0.02286 0.41189 6.84411
30 4P42 PEE 0.02592 0.41003 7.05128
31 2YIP YIO 0.01006 0.41348 7.24638
32 4CLI 5P8 0.04159 0.41525 7.37179
33 2P7Q GG6 0.005412 0.42254 7.5188
34 4B1M FRU FRU 0.006922 0.403 7.56757
35 4B1L FRU 0.007247 0.40222 8.48485
36 5HV0 AKG 0.005474 0.43046 8.75576
37 5UKL SIX 0.01741 0.4213 11.2903
38 2BOS GLA GAL 0.0009879 0.43598 13.2353
39 2BOS GLA GAL GLC 0.001103 0.43315 13.2353
40 3HXG GTA 0.01348 0.4116 14.2857
Pocket No.: 6; Query (leader) PDB : 1OFZ; Ligand: FUC; Similar sites found: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 6) in the query (biounit: 1ofz.bio1) has 13 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
Pocket No.: 7; Query (leader) PDB : 1OFZ; Ligand: FUL; Similar sites found: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 7) in the query (biounit: 1ofz.bio1) has 8 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
Pocket No.: 8; Query (leader) PDB : 1OFZ; Ligand: FUL; Similar sites found: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 8) in the query (biounit: 1ofz.bio1) has 12 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
Pocket No.: 9; Query (leader) PDB : 1OFZ; Ligand: FUL; Similar sites found: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 9) in the query (biounit: 1ofz.bio1) has 8 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
Pocket No.: 10; Query (leader) PDB : 1OFZ; Ligand: FUC; Similar sites found: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 10) in the query (biounit: 1ofz.bio1) has 12 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
Pocket No.: 11; Query (leader) PDB : 1OFZ; Ligand: FUL; Similar sites found: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 11) in the query (biounit: 1ofz.bio1) has 8 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
Pocket No.: 12; Query (leader) PDB : 1OFZ; Ligand: FUL; Similar sites found: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 12) in the query (biounit: 1ofz.bio1) has 10 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
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