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Ligand clusters for UniProt code Q9Y657
Ligand clusters for Q9Y657: Spindlin-1 from Homo sapiens
Top 6 (of 14) ligand clusters
Cluster 1.
20 ligand types
26 ligands
Cluster 2.
1 ligand type
1 ligand
Cluster 3.
5 ligand types
7 ligands
Cluster 4.
2 ligand types
2 ligands
Cluster 5.
1 ligand type
1 ligand
Cluster 6.
1 ligand type
1 ligand
Representative protein: 5y5wA
Structures
PDB
Schematic diagram
5y5w
A
5y5w
C
4mzf
B
4mzg
B
4mzh
A
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Cluster 1 contains 20 ligand types
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Ligand
Description
1. Ligand:
DMS × 3
dimethyl sulfoxide
Dimethyl sulfoxide
PDB codes:
6i8b
(B),
6qpl
(B).
2. Ligand:
2OD × 2
5'-Methoxy-6'-[3-(Pyrrolidin-1-Yl) propoxy]spiro[cyclobutane-1,3'-Indol]-2'-Amine
PDB codes:
6i8y
(A),
3. Ligand:
ARG-HIS-ARG-M3L-VAL × 2
M3L
=N-Trimethyllysine.
PDB codes:
5y5w
(A),
4. Ligand:
MPD × 2
(4s)-2-Methyl-2,4-Pentanediol
PDB codes:
6i8y
(A),
6qpl
(B).
5. Ligand:
MRD × 2
(4r)-2-Methylpentane-2,4-Diol
PDB codes:
4mzg
(B),
6i8l
(B).
6. Ligand:
6P9 × 1
[2-(Phenylamino)-1,4-Phenylene]bis({4-[2-(Pyrrolidin-1- Yl)ethyl]piperidin-1-Yl}methanone)
PDB code:
5jsg
(A).
7. Ligand:
6PD × 1
[4-(2-Pyrrolidin-1-Ylethyl)piperidin-1-Yl]-[4-[4-(2- Pyrrolidin-1-Ylethyl)piperidin-1-Yl]carbonyl-
3-[[4- (Pyrrolidin-1-Ylmethoxy)phenyl]amino]phenyl]methanone
PDB code:
5jsj
(A).
8. Ligand:
ALA-ARG-THR-M3L-GLN-THR-ALA × 1
M3L
=N-Trimethyllysine.
PDB code:
4mzh
(A).
9. Ligand:
ALA-ARG-THR-M3L-GLN-THR-ALA-ARG × 1
M3L
=N-Trimethyllysine.
PDB code:
4h75
(A).
10. Ligand:
ALA-ARG-THR-M3L-GLN-THR-ALA-ARG-LYS × 1
M3L
=N-Trimethyllysine.
PDB code:
4mzg
(B).
11. Ligand:
ALA-ARG-THR-M3L-GLN-THR-ALA-ARG-M3L-SER × 1
M3L
=N-Trimethyllysine.
PDB code:
7bqz
(E).
12. Ligand:
ALA-ARG-THR-M3L-GLN-THR-ALA-ARG-MLY × 1
M3L
=N-Trimethyllysine,
MLY
=N-Dimethyl-Lysine.
PDB code:
7bu9
(A).
13. Ligand:
ALA-ARG-THR-M3L-GLN-THR-ALA-DA2-LYS × 1
M3L
=N-Trimethyllysine,
DA2
=Ng,Ng-Dimethyl-L-Arginine.
PDB code:
4mzf
(B).
14. Ligand:
EDO × 1
1,2-Ethanediol
PDB code:
6i8y
(A).
15. Ligand:
H7Q × 1
5'-(Cyclopropylmethoxy)-6'-[3-(1,3-Dihydroisoindol-2- Yl)propoxy]spiro[cyclopentane-1,3'-Indole]-
2'-Amine
PDB code:
6i8l
(B).
16. Ligand:
H7T × 1
2-[4-[2-[[2-[3-[2-Azanyl-5-(Cyclopropylmethoxy)-3,3- Dimethyl-Indol-6-Yl]oxypropyl]-1,3-
Dihydroisoindol-5- Yl]oxy]ethyl]-1,2,3-Triazol-1-Yl]-1-[4-(2-Pyrrolidin- 1-Ylethyl)piperidin-1-
Yl]ethanone
PDB code:
6i8b
(B).
17. Ligand:
HIS-ARG-M3L-VAL × 1
M3L
=N-Trimethyllysine.
PDB code:
5y5w
(B).
18. Ligand:
JC5 × 1
[3-(Aminomethyl)-5-[3-(1,3-Dihydroisoindol-2-Yl) propoxy]-4-Methoxy-Phenyl]methanamine
PDB code:
6qpl
(B).
19. Ligand:
NHE × 1
2-[N-Cyclohexylamino]ethane sulfonic acid
PDB code:
4h75
(A).
20. Ligand:
SO4 × 1
Sulfate ion
PDB code:
4h75
(A).
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Cluster 2 contains 1 ligand type
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Ligand
Description
1. Ligand:
H7T × 1
2-[4-[2-[[2-[3-[2-Azanyl-5-(Cyclopropylmethoxy)-3,3- Dimethyl-Indol-6-Yl]oxypropyl]-1,3-
Dihydroisoindol-5- Yl]oxy]ethyl]-1,2,3-Triazol-1-Yl]-1-[4-(2-Pyrrolidin- 1-Ylethyl)piperidin-1-
Yl]ethanone
PDB code:
6i8b
(B).
Cluster 3 contains 5 ligand types
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Ligand
Description
1. Ligand:
DMS × 1
dimethyl sulfoxide
Dimethyl sulfoxide
PDB code:
6i8b
(B).
2. Ligand:
GLY × 1
glycine
PDB code:
6i8b
(B).
3. Ligand:
GOL × 1
glycerin
Glycerol
PDB code:
6i8y
(A).
4. Ligand:
MPD × 3
(4s)-2-Methyl-2,4-Pentanediol
PDB codes:
4mzg
(B),
6i8l
(B),
6qpl
(B).
5. Ligand:
BAM × 1
Benzamidine
PDB code:
7cna
(A).
Cluster 4 contains 2 ligand types
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Ligand
Description
1. Ligand:
GOL × 1
glycerin
Glycerol
PDB code:
4h75
(A).
2. Ligand:
PO4 × 1
Phosphate ion
PDB code:
2ns2
(A).
Cluster 5 contains 1 ligand type
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Ligand
Description
1. Ligand:
BAM × 1
Benzamidine
PDB code:
7cna
(A).
Cluster 6 contains 1 ligand type
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Ligand
Description
1. Ligand:
GOL × 1
glycerin
Glycerol
PDB code:
6qpl
(B).