Receptor
PDB id Resolution Class Description Source Keywords
3MT6 1.9 Å EC: 3.4.21.92 STRUCTURE OF CLPP FROM ESCHERICHIA COLI IN COMPLEX WITH ADEP ESCHERICHIA COLI ENDOPEPTIDASE CLP CASEINOLYTIC PROTEASE PROTEASE TI ACYPDEPSIPEPTIDE ANTIBIOTICS HYDROLASE-ANTIBIOTIC COMPLEX
Ref.: ACYLDEPSIPEPTIDE ANTIBIOTICS INDUCE THE FORMATION O STRUCTURED AXIAL CHANNEL IN CLPP: A MODEL FOR THE CLPX/CLPA-BOUND STATE OF CLPP. CHEM.BIOL. V. 17 959 2010
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
MPD A:800;
A:801;
B:800;
B:801;
C:800;
C:801;
D:800;
D:801;
E:802;
E:803;
E:801;
F:800;
G:800;
G:801;
H:800;
I:800;
I:801;
J:800;
J:801;
K:800;
K:801;
L:800;
L:801;
M:203;
M:201;
M:202;
N:800;
N:801;
O:800;
O:801;
P:800;
P:801;
Q:800;
Q:801;
R:203;
R:201;
R:202;
S:800;
T:800;
T:801;
U:201;
U:202;
V:201;
V:202;
W:800;
W:801;
X:201;
X:202;
Y:800;
Z:802;
Z:803;
Z:801;
A:800;
B:800;
B:801;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
submit data
118.174 C6 H14 O2 C[C@@...
OTT PHE SER PRO MAA ALA MP8 1:700;
2:700;
3:700;
4:700;
C:700;
D:700;
E:700;
F:700;
G:700;
H:700;
I:700;
J:700;
K:700;
L:700;
M:700;
N:700;
Z:301;
P:700;
Q:700;
R:700;
S:700;
T:700;
U:700;
V:700;
W:700;
X:700;
Y:700;
O:700;
Valid;
Valid;
Valid;
Valid;
Valid;
Valid;
Valid;
Valid;
Valid;
Valid;
Valid;
Valid;
Valid;
Valid;
Valid;
Valid;
Valid;
Valid;
Valid;
Valid;
Valid;
Valid;
Valid;
Valid;
Valid;
Valid;
Valid;
Valid;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
submit data
722.884 n/a O=C(N...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
3MT6 1.9 Å EC: 3.4.21.92 STRUCTURE OF CLPP FROM ESCHERICHIA COLI IN COMPLEX WITH ADEP ESCHERICHIA COLI ENDOPEPTIDASE CLP CASEINOLYTIC PROTEASE PROTEASE TI ACYPDEPSIPEPTIDE ANTIBIOTICS HYDROLASE-ANTIBIOTIC COMPLEX
Ref.: ACYLDEPSIPEPTIDE ANTIBIOTICS INDUCE THE FORMATION O STRUCTURED AXIAL CHANNEL IN CLPP: A MODEL FOR THE CLPX/CLPA-BOUND STATE OF CLPP. CHEM.BIOL. V. 17 959 2010
Members (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 6 families.
1 3MT6 - OTT PHE SER PRO MAA ALA MP8 n/a n/a
70% Homology Family (8)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 2 families.
1 3MT6 - OTT PHE SER PRO MAA ALA MP8 n/a n/a
2 3KTI - OTT PHE SER PRO MAA ALA MP8 n/a n/a
3 5DKP - OTT PHE SER PRO MAA ALA MP8 n/a n/a
4 2ZL4 - ALA ALA ALA ALA n/a n/a
5 2ZL2 - ASN VAL LEU GLY PHE THR GLN n/a n/a
6 6TTZ - NWT C39 H52 F2 N6 O8 CCCC/C=C/C....
7 6PKA Kd = 1.19 uM OO1 WFP SER PRO YCP ALA MP8 n/a n/a
8 6PMD - SHV WFP SER PRO YCP ALA MP8 n/a n/a
50% Homology Family (9)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1 families.
1 3MT6 - OTT PHE SER PRO MAA ALA MP8 n/a n/a
2 3KTI - OTT PHE SER PRO MAA ALA MP8 n/a n/a
3 5DKP - OTT PHE SER PRO MAA ALA MP8 n/a n/a
4 2ZL4 - ALA ALA ALA ALA n/a n/a
5 2ZL2 - ASN VAL LEU GLY PHE THR GLN n/a n/a
6 6TTZ - NWT C39 H52 F2 N6 O8 CCCC/C=C/C....
7 6PKA Kd = 1.19 uM OO1 WFP SER PRO YCP ALA MP8 n/a n/a
8 6PMD - SHV WFP SER PRO YCP ALA MP8 n/a n/a
9 6DL7 - ONC C24 H24 N4 O Cc1ccccc1C....
Polypharmacology
Similar Ligands (2D)
Ligand no: 1; Ligand: OTT PHE SER PRO MAA ALA MP8; Similar ligands found: 4
No: Ligand ECFP6 Tc MDL keys Tc
1 OTT PHE SER PRO MAA ALA MP8 1 1
2 SHV WFP SER PRO YCP ALA MP8 0.509434 0.833333
3 NWT 0.509434 0.833333
4 OO1 WFP SER PRO YCP ALA MP8 0.490798 0.776316
Similar Ligands (3D)
Ligand no: 1; Ligand: OTT PHE SER PRO MAA ALA MP8; 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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