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.
3CFL_A_5CHA693_1
(LACTOTRANSFERRIN)
1lcy HTRA2 SERINE
PROTEASE
(Homo
sapiens)
4 / 4THR A 138
VAL A 178
GLY A 174
THR A  62
None
0.86A22.85
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.
3CFL_A_5CHA693_1
(LACTOTRANSFERRIN)
2ill TITIN
(Homo
sapiens)
4 / 4THR A  27
VAL A  34
GLY A  88
THR A  89
None
1.06A17.39
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.
3CFL_A_5CHA693_1
(LACTOTRANSFERRIN)
2wek ZINC-BINDING ALCOHOL
DEHYDROGENASE
DOMAIN-CONTAINING
PROTEIN 2
(Homo
sapiens)
4 / 4THR A 179
VAL A 241
GLY A 230
THR A 231
None
0.90A21.72
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.
3CFL_A_5CHA693_1
(LACTOTRANSFERRIN)
3num SERINE PROTEASE
HTRA1
(Homo
sapiens)
4 / 4THR A 293
VAL A 333
GLY A 329
THR A 217
None
0.88A20.81
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.
3CFL_A_5CHA693_1
(LACTOTRANSFERRIN)
3nwu SERINE PROTEASE
HTRA1
(Homo
sapiens)
4 / 4THR A 293
VAL A 333
GLY A 329
THR A 217
None
0.90A20.11
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.
3CFL_A_5CHA693_1
(LACTOTRANSFERRIN)
4iyp IMMUNOGLOBULIN-BINDI
NG PROTEIN 1
(Homo
sapiens)
4 / 4THR A  89
VAL A  26
GLY A  19
THR A  18
None
0.87A20.34
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.
3CFL_A_5CHA693_1
(LACTOTRANSFERRIN)
4ri0 SERINE PROTEASE
HTRA3
(Homo
sapiens)
4 / 4THR A 270
VAL A 310
GLY A 306
THR A 188
None
0.88A20.63
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.
3CFL_A_5CHA693_1
(LACTOTRANSFERRIN)
4uml GANGLIOSIDE-INDUCED
DIFFERENTIATION-ASSO
CIATED PROTEIN 2
(Homo
sapiens)
4 / 4THR A 188
VAL A 152
GLY A 110
THR A 109
None
1.05A21.71
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.
3CFL_A_5CHA693_1
(LACTOTRANSFERRIN)
5n8m RISC-LOADING COMPLEX
SUBUNIT TARBP2
(Homo
sapiens)
4 / 4THR A  71
VAL A  47
GLY A  39
THR A  40
None
None
None
C  B  19 ( 2.9A)
1.05A12.03
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.
3CFL_A_5CHA693_1
(LACTOTRANSFERRIN)
6ca7 PCT64_13C HEAVY
CHAIN
(Homo
sapiens)
4 / 4THR H  28
VAL H  78
GLY H  55
THR H  56
None
0.79A13.85