Receptor
PDB id Resolution Class Description Source Keywords
1BXM 2.15 Å NON-ENZYME: TOXIN_VIRAL ENGINEERED BETA-CRYPTOGEIN COMPLEXED WITH ERGOSTEROL PHYTOPHTHORA CRYPTOGEA FUNGAL TOXIC ELICITOR MUTANT ELICITIN PHYTOPHTHORA STEROL PLANT PATHOGEN
Ref.: THE 2.1 A STRUCTURE OF AN ELICITIN-ERGOSTEROL COMPLEX: A RECENT ADDITION TO THE STEROL CARRIER PROTEIN FAMILY. PROTEIN SCI. V. 8 1191 1999
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
ERG A:99;
 Valid;
 none;
 submit data
396.648 C28 H44 O CC(C)...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
1LRI 1.45 Å NON-ENZYME: TOXIN_VIRAL BETA-CRYPTOGEIN-CHOLESTEROL COMPLEX PHYTOPHTHORA CRYPTOGEA CRYPTOGEIN CHOLESTEROL STEROL CARRIER PROTEIN TOXIN
Ref.: THE 1.45 A RESOLUTION STRUCTURE OF THE CRYPTOGEIN-CHOLESTEROL COMPLEX: A CLOSE-UP VIEW OF A STEROL CARRIER PROTEIN (SCP) ACTIVE SITE. ACTA CRYSTALLOGR.,SECT.D V. 58 1442 2002
Members (2)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 64 families.
1 1BXM - ERG C28 H44 O CC(C)[C@@H....
2 1LRI - CLR C27 H46 O CC(C)CCC[C....
70% Homology Family (3)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 44 families.
1 1BXM - ERG C28 H44 O CC(C)[C@@H....
2 1LRI - CLR C27 H46 O CC(C)CCC[C....
3 2AIB - ERG C28 H44 O CC(C)[C@@H....
50% Homology Family (3)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 36 families.
1 1BXM - ERG C28 H44 O CC(C)[C@@H....
2 1LRI - CLR C27 H46 O CC(C)CCC[C....
3 2AIB - ERG C28 H44 O CC(C)[C@@H....
Polypharmacology
Similar Ligands (2D)
Ligand no: 1; Ligand: ERG; Similar ligands found: 1
No: Ligand ECFP6 Tc MDL keys Tc
1 ERG 1 1
Similar Ligands (3D)
Ligand no: 1; Ligand: ERG; Similar ligands found: 23
No: Ligand Similarity coefficient
1 CLR 0.9665
2 HCR 0.9612
3 K2B 0.9450
4 HC3 0.9450
5 5JK 0.9394
6 HCD 0.9356
7 HC9 0.9308
8 0T9 0.9305
9 D7S 0.9213
10 DL7 0.9134
11 DL4 0.9132
12 L39 0.9119
13 HC2 0.9119
14 2DC 0.9117
15 TH2 0.8976
16 98H 0.8916
17 LAN 0.8887
18 38O 0.8836
19 C3S 0.8750
20 4D8 0.8672
21 J60 0.8592
22 HE7 0.8566
23 82R 0.8554
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 1LRI; Ligand: CLR; 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: 1lri.bio1) has 25 residues
No: Leader PDB Ligand Sequence Similarity
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