-->
Receptor
PDB id Resolution Class Description Source Keywords
2P1M 1.8 Å NON-ENZYME: OTHER TIR1-ASK1 COMPLEX STRUCTURE ARABIDOPSIS THALIANA F-BOX LEUCINE RICH REPEAT SIGNALING PROTEIN
Ref.: MECHANISM OF AUXIN PERCEPTION BY THE TIR1 UBIQUITIN LIGASE NATURE V. 446 640 2007
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
IHP B:601;
Valid;
none;
submit data
660.035 C6 H18 O24 P6 C1(C(...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
2P1M 1.8 Å NON-ENZYME: OTHER TIR1-ASK1 COMPLEX STRUCTURE ARABIDOPSIS THALIANA F-BOX LEUCINE RICH REPEAT SIGNALING PROTEIN
Ref.: MECHANISM OF AUXIN PERCEPTION BY THE TIR1 UBIQUITIN LIGASE NATURE V. 446 640 2007
Members (2)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1443 families.
1 2P1P - IHP C6 H18 O24 P6 C1(C(C(C(C....
2 2P1M - IHP C6 H18 O24 P6 C1(C(C(C(C....
70% Homology Family (2)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1205 families.
1 2P1P - IHP C6 H18 O24 P6 C1(C(C(C(C....
2 2P1M - IHP C6 H18 O24 P6 C1(C(C(C(C....
50% Homology Family (2)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1039 families.
1 2P1P - IHP C6 H18 O24 P6 C1(C(C(C(C....
2 2P1M - IHP C6 H18 O24 P6 C1(C(C(C(C....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: IHP; Similar ligands found: 23
No: Ligand ECFP6 Tc MDL keys Tc
1 IHP 1 1
2 I6P 1 1
3 5IP 0.652174 1
4 5MY 0.652174 1
5 IP5 0.652174 1
6 I5P 0.652174 1
7 I0P 0.608696 0.965517
8 I8P 0.6 0.965517
9 2YN 0.6 0.965517
10 I7P 0.6 0.965517
11 I4P 0.571429 1
12 5A2 0.555556 0.8
13 4WZ 0.555556 0.8
14 5A3 0.555556 0.8
15 2IP 0.545455 0.933333
16 4IP 0.538462 0.965517
17 ITP 0.52 0.933333
18 IP2 0.5 0.933333
19 I3S 0.481481 0.933333
20 I3P 0.481481 0.933333
21 I4D 0.48 0.9
22 0EJ 0.46875 0.823529
23 4WY 0.454545 0.8
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 2P1M; Ligand: IHP; Similar sites found with APoc: 47
This union binding pocket(no: 1) in the query (biounit: 2p1m.bio1) has 27 residues
No: Leader PDB Ligand Sequence Similarity
1 6GNO XDI 2.22222
2 2EV9 SKM 2.6616
3 2I74 MAN MAN MAN MAN 2.6936
4 6FA4 D1W 2.89017
5 3PA8 621 3.75
6 4HWT 1B2 3.75
7 1QGQ UDP 3.75
8 3DOO SKM 3.97112
9 4RF7 ARG 4.375
10 2VL1 GLY GLY 4.375
11 5OCG 9R5 4.375
12 2GPT SKM 5
13 3THR C2F 5.11945
14 4WOE ADP 5.625
15 3ITA AIC 5.625
16 1GVF PGH 5.625
17 2AZ3 CDP 6.09756
18 3HCH RSM 6.16438
19 2F2H XTG 6.25
20 5EXK MET 6.64653
21 1F9V ADP 7.5
22 3JQ3 ADP 7.5
23 4PSR FUL 8.125
24 1SDW IYT 8.125
25 3SAO DBH 8.125
26 2AGC DAO 9.375
27 5WL1 D3D 9.375
28 3H0L ADP 9.57447
29 1OFL NGK GCD 9.77131
30 4UMJ BFQ 10.1351
31 1LSH PLD 10.625
32 3IWD M2T 11.2903
33 5FUI APY 12.1212
34 4LIT AKG 12.7764
35 5L2R MLA 14.375
36 3CBC DBS 15
37 5HWV MBN 16.1538
38 1I7M CG 16.4179
39 3DZ6 PUT 16.4179
40 3A8H TAY 16.4251
41 3TTZ 07N 17.1717
42 4MPO AMP 17.6471
43 5KJW 53C 18.125
44 2Z3U CRR 19.375
45 5TVF CGQ 21.25
46 1W8S FBP 21.875
47 6EWZ APC 22.3629
Pocket No.: 2; Query (leader) PDB : 2P1M; Ligand: IHP; Similar sites found with APoc: 2
This union binding pocket(no: 2) in the query (biounit: 2p1m.bio2) has 27 residues
No: Leader PDB Ligand Sequence Similarity
1 43CA NPO 13.2743
2 3NZ1 3NY 13.75
Pocket No.: 3; Query (leader) PDB : 2P1M; Ligand: IHP; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 3) in the query (biounit: 2p1m.bio2) has 27 residues
No: Leader PDB Ligand Sequence Similarity
APoc FAQ
Feedback