Receptor
PDB id Resolution Class Description Source Keywords
1CKB 1.9 Å NON-ENZYME: TRANSCRIPT_TRANSLATE STRUCTURAL BASIS FOR THE SPECIFIC INTERACTION OF LYSINE- CONTAINING PROLINE-RICH PEPTIDES WITH THE N-TERMINAL SH3 D OMAIN OF C-CRK MUS MUSCULUS COMPLEX (ONCOGENE PROTEIN/PEPTIDE)
Ref.: STRUCTURAL BASIS FOR THE SPECIFIC INTERACTION OF LYSINE-CONTAINING PROLINE-RICH PEPTIDES WITH THE N-TERMINAL SH3 DOMAIN OF C-CRK. STRUCTURE V. 3 215 1995
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
PRO PRO PRO VAL PRO PRO ARG ARG ARG ARG B:1;
 Valid;
 none;
 Kd = 5.2 uM
801.027 n/a O=C(N...
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90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
1CKA 1.5 Å NON-ENZYME: TRANSCRIPT_TRANSLATE STRUCTURAL BASIS FOR THE SPECIFIC INTERACTION OF LYSINE- CONTAINING PROLINE-RICH PEPTIDES WITH THE N-TERMINAL SH3 D OMAIN OF C-CRK MUS MUSCULUS COMPLEX (ONCOGENE PROTEIN/PEPTIDE)
Ref.: STRUCTURAL BASIS FOR THE SPECIFIC INTERACTION OF LYSINE-CONTAINING PROLINE-RICH PEPTIDES WITH THE N-TERMINAL SH3 DOMAIN OF C-CRK. STRUCTURE V. 3 215 1995
Members (2)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 308 families.
1 1CKB Kd = 5.2 uM PRO PRO PRO VAL PRO PRO ARG ARG ARG ARG n/a n/a
2 1CKA Kd = 1.9 uM PRO PRO PRO ALA LEU PRO PRO LYS LYS ARG n/a n/a
70% Homology Family (2)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 266 families.
1 1CKB Kd = 5.2 uM PRO PRO PRO VAL PRO PRO ARG ARG ARG ARG n/a n/a
2 1CKA Kd = 1.9 uM PRO PRO PRO ALA LEU PRO PRO LYS LYS ARG n/a n/a
50% Homology Family (14)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 40 families.
1 6A9C - LYS VAL ALA PRO PRO ILE PRO HIS ARG n/a n/a
2 2J6O Kd ~ 100 uM LYS GLY PRO PRO LEU PRO ARG PRO ARG VAL n/a n/a
3 1CKB Kd = 5.2 uM PRO PRO PRO VAL PRO PRO ARG ARG ARG ARG n/a n/a
4 1CKA Kd = 1.9 uM PRO PRO PRO ALA LEU PRO PRO LYS LYS ARG n/a n/a
5 1FYN - PRO PRO ALA TYR PRO PRO PRO PRO VAL PRO n/a n/a
6 1ABO - ALA PRO THR MET PRO PRO PRO LEU PRO PRO n/a n/a
7 2W0Z - ALA PRO PRO PRO ARG PRO PRO LYS PRO n/a n/a
8 2D0N - PRO SER ILE ASP ARG SER THR LYS PRO n/a n/a
9 1YWO Kd = 12.5 uM GLN PRO PRO VAL PRO PRO GLN ARG PRO MET n/a n/a
10 2AK5 Kd = 14 uM ARG PRO PRO LYS PRO ARG PRO ARG n/a n/a
11 2SEM - ACE PRO PRO PRO VAL IPG PRO ARG ARG n/a n/a
12 3SEM - PRO PRO PRO VAL NMC PRO ARG ARG ARG n/a n/a
13 1SEM Kd = 43 uM ACE PRO PRO PRO VAL PRO PRO ARG ARG ARG n/a n/a
14 4HXJ Kd ~ 74.3 uM ARG GLY THR n/a n/a
Polypharmacology
Similar Ligands (2D)
Ligand no: 1; Ligand: PRO PRO PRO VAL PRO PRO ARG ARG ARG ARG; Similar ligands found: 51
No: Ligand ECFP6 Tc MDL keys Tc
1 PRO PRO PRO VAL PRO PRO ARG ARG ARG ARG 1 1
2 PRO PRO PRO VAL PRO PRO TYR SER ALA GLY 0.61165 0.859649
3 PRO PRO LYS LYS LYS ARG LYS VAL 0.586207 0.982456
4 PRO PRO GLY PRO ARG GLY PRO PRO GLY 0.583333 0.9
5 ACE PRO PRO PRO VAL PRO PRO ARG ARG ARG 0.581818 0.949153
6 PRO PRO LYS ARG ILE ALA 0.535433 0.901639
7 GLN PRO PRO VAL PRO PRO GLN ARG PRO MET 0.533835 0.876923
8 LEU PRO PRO GLU GLU ARG LEU ILE 0.527559 0.903226
9 LYS GLY PRO PRO LEU PRO ARG PRO ARG VAL 0.512397 0.982759
10 PRO PRO PRO ALA LEU PRO PRO LYS LYS ARG 0.511811 0.87931
11 PRO PRO PRO PRO PRO PRO LEU PRO PRO 0.504425 0.862069
12 PRO PRO PRO MET ALA GLY GLY 0.5 0.757576
13 VAL PRO PRO PRO ARG PRO PRO PRO PRO GLU 0.483607 0.885246
14 PRO PRO ARG PRO ILE TYR ASN ARG ASN 0.482517 0.8
15 PRO PRO PRO PRO PRO PRO PRO PRO PRO LEU 0.481132 0.862069
16 ALA PRO PRO PRO ARG PRO PRO LYS PRO 0.479675 0.931035
17 ILE ARG ALA ALA PRO PRO PRO LEU PHE 0.461538 0.890625
18 MET PRO PRO PRO PRO TPO PRO ARG SER 0.458333 0.731343
19 VAL PRO PRO PRO VAL PRO PRO PRO PRO SER 0.455357 0.836066
20 PRO ARG ARG PRO VAL ILE MET ARG ARG 0.453237 0.904762
21 PRO PRO PRO VAL NMC PRO ARG ARG ARG 0.45082 0.833333
22 DPN PRO DAR ILE NH2 0.448 0.868852
23 DPN PRO DAR DTH NH2 0.448 0.8
24 PRO GLU PRO THR ALA PRO PRO GLU GLU 0.440298 0.757576
25 MET PRO PRO PRO PRO SEP PRO CYS THR 0.439024 0.720588
26 SER PRO LYS ARG ILE ALA 0.4375 0.84375
27 ACE PRO PRO PRO VAL IPG PRO ARG ARG 0.433071 0.933333
28 ACE GLN GLU ARG GLU VAL PRO CYS 0.431818 0.887097
29 ARG PRO PRO ILE PHE ILE ARG ARG LEU 0.431507 0.904762
30 ACE SER LEU ARG PRO ALA PRO LPD 0.428571 0.876923
31 THR PRO ARG VAL THR GLY GLY GLY ALA MET 0.427586 0.788732
32 ARG PRO PRO LYS PRO ARG PRO ARG 0.426357 0.929825
33 GLY MET PRO ARG GLY ALA 0.426357 0.84375
34 PRO GLU ALA THR ALA PRO PRO GLU GLU 0.425373 0.757576
35 5JP PRO LYS ARG ILE ALA 0.424242 0.818182
36 VAL MET ALA PRO ARG ALA LEU LEU LEU 0.423358 0.846154
37 THR PRO ARG ARG SER MLZ SER ALA 0.423077 0.797101
38 ACE GLU VAL ASN PRO PRO VAL LPD 0.423077 0.78125
39 ACE GLU VAL ALA PRO PRO VAL LPD 0.420635 0.819672
40 ACE GLU VAL ASN PRO PRO VAL PRO NH2 0.416667 0.78125
41 DPN PRO DAR CYS NH2 0.412698 0.836066
42 MET CYS PRO ARG MET THR ALA VAL MET 0.412162 0.811594
43 PRO SER ARG VAL 0.408696 0.75
44 LYS VAL ALA PRO PRO ILE PRO HIS ARG 0.407643 0.904762
45 PHE ASN ARG PRO VAL 0.407407 0.830769
46 ARG PRO LYS ARG ILE ALA 0.407407 0.901639
47 VAL MET LEU PRO GLY ARG GLY VAL PRO 0.406667 0.904762
48 PRO THR PRO SER ALA PRO VAL PRO LEU 0.404762 0.761194
49 ARG PRO GLN VAL PRO LEU ARG PRO MET 0.40411 0.876923
50 THR PRO THR ARG ASP VAL ALA THR SER PRO 0.401408 0.863636
51 ALA ASN SER ARG VAL PRO THR SER ILE ILE 0.4 0.820895
Similar Ligands (3D)
Ligand no: 1; Ligand: PRO PRO PRO VAL PRO PRO ARG ARG ARG ARG; Similar ligands found: 0
No: Ligand Similarity coefficient
Similar Binding Sites (Proteins are less than 50% similar to leader) APoc FAQ
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