POTENTIAL TARGETS FROM HUMAN (RESULTS FROM SUB-STRUCTURAL SIMILARITY SEARCHES)
1) User may click on the DrReposER ID (the second column) to get information on the binding sites and drug molecule.
2) Click View (the second last column) to view matched residues and superposition in the NGL viewer (upper right part).
3) User may also click on the Dock (the last column) to get script for molecular docking in UCSF Chimera through AutoDock Vina.


DrReposER ID / Desc. Hit
PDBID
Hit
Macromolecule
Res.
Matches
Interface HETATM RMSD Seq.
Identity (%)
View Dock
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4K17_B_OHBB701_0
(LEUCINE-RICH
REPEAT-CONTAINING
PROTEIN 16A)
1e5w MOESIN
(Homo
sapiens)
4 / 5GLU A  92
SER A  90
ARG A 294
PRO A  86
None
1.14A19.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4K17_B_OHBB701_0
(LEUCINE-RICH
REPEAT-CONTAINING
PROTEIN 16A)
1now BETA-HEXOSAMINIDASE
BETA CHAIN
(Homo
sapiens)
4 / 5GLU A 147
SER A 148
PRO A 198
SER A 197
None
GOL  A 558 (-3.1A)
None
None
1.20A20.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4K17_B_OHBB701_0
(LEUCINE-RICH
REPEAT-CONTAINING
PROTEIN 16A)
2bka TAT-INTERACTING
PROTEIN TIP30
(Homo
sapiens)
4 / 5GLU A 176
SER A 197
PRO A 202
SER A 200
None
1.45A17.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4K17_B_OHBB701_0
(LEUCINE-RICH
REPEAT-CONTAINING
PROTEIN 16A)
2gk1 BETA-HEXOSAMINIDASE
SUBUNIT BETA CHAIN B
(Homo
sapiens)
4 / 5GLU M 147
SER M 148
PRO M 198
SER M 197
None
1.25A13.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4K17_B_OHBB701_0
(LEUCINE-RICH
REPEAT-CONTAINING
PROTEIN 16A)
2kjd SODIUM/HYDROGEN
EXCHANGE REGULATORY
COFACTOR NHE-RF1
(Homo
sapiens)
4 / 5GLU A  66
ARG A  56
PRO A 104
SER A 105
None
1.30A12.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4K17_B_OHBB701_0
(LEUCINE-RICH
REPEAT-CONTAINING
PROTEIN 16A)
2kw6 CYCLIN-DEPENDENT
KINASE 2-ASSOCIATED
PROTEIN 1
(Homo
sapiens)
4 / 5GLU A  76
SER A  86
PRO A  79
SER A  84
None
1.17A5.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4K17_B_OHBB701_0
(LEUCINE-RICH
REPEAT-CONTAINING
PROTEIN 16A)
3msx RHO
GTPASE-ACTIVATING
PROTEIN 20
(Homo
sapiens)
4 / 5GLU B 529
SER B 525
PRO B 520
SER B 524
None
1.21A14.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4K17_B_OHBB701_0
(LEUCINE-RICH
REPEAT-CONTAINING
PROTEIN 16A)
3ux9 INTERFERON
ALPHA-1/13
(Homo
sapiens)
4 / 5GLU A 142
ARG A 145
PRO A  26
SER A  27
None
1.44A13.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4K17_B_OHBB701_0
(LEUCINE-RICH
REPEAT-CONTAINING
PROTEIN 16A)
4az3 LYSOSOMAL PROTECTIVE
PROTEIN 32 KDA CHAIN
(Homo
sapiens)
4 / 5GLU A  40
ARG A  20
PRO A  45
SER A  48
None
1.34A19.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4K17_B_OHBB701_0
(LEUCINE-RICH
REPEAT-CONTAINING
PROTEIN 16A)
4gqb PROTEIN ARGININE
N-METHYLTRANSFERASE
5
(Homo
sapiens)
4 / 5GLU A 207
ARG A 154
PRO A 232
SER A 234
None
1.28A21.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4K17_B_OHBB701_0
(LEUCINE-RICH
REPEAT-CONTAINING
PROTEIN 16A)
4ks8 SERINE/THREONINE-PRO
TEIN KINASE PAK 6
(Homo
sapiens)
4 / 5GLU A 571
SER A 576
ARG A 646
SER A 574
None
1.47A18.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4K17_B_OHBB701_0
(LEUCINE-RICH
REPEAT-CONTAINING
PROTEIN 16A)
4lx1 UNCONVENTIONAL
MYOSIN-VA
(Homo
sapiens)
4 / 5GLU A1550
SER A1671
ARG A1496
SER A1668
None
1.36A22.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4K17_B_OHBB701_0
(LEUCINE-RICH
REPEAT-CONTAINING
PROTEIN 16A)
5jpn COMPLEMENT C4-A
COMPLEMENT C4-A
(Homo
sapiens;
Homo
sapiens)
4 / 5GLU C1534
SER C1532
ARG B 722
PRO C1530
None
1.15A19.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4K17_B_OHBB701_0
(LEUCINE-RICH
REPEAT-CONTAINING
PROTEIN 16A)
6f1d COMPLEMENT C1R
SUBCOMPONENT
(Homo
sapiens)
4 / 5GLU A 192
SER A 190
ARG A 195
SER A 189
None
NA  A 301 (-2.8A)
None
None
1.26Aundetectable