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.
5IGZ_A_SPRA404_2
(MACROLIDE
2'-PHOSPHOTRANSFERAS
E II)
1bkd SON OF SEVENLESS-1
(Homo
sapiens)
5 / 9LEU S 788
HIS S 827
ILE S 855
GLU S 857
VAL S 861
None
0.70A19.38
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.
5IGZ_A_SPRA404_2
(MACROLIDE
2'-PHOSPHOTRANSFERAS
E II)
1xdv SON OF SEVENLESS
PROTEIN HOMOLOG 1
(Homo
sapiens)
5 / 9LEU A 788
HIS A 827
ILE A 855
GLU A 857
VAL A 861
None
0.70A14.52
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.
5IGZ_A_SPRA404_2
(MACROLIDE
2'-PHOSPHOTRANSFERAS
E II)
2iu1 EUKARYOTIC
TRANSLATION
INITIATION FACTOR 5
(Homo
sapiens)
5 / 9LEU A 314
ILE A 293
ILE A 351
GLU A 349
GLU A 319
None
1.20A20.66
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.
5IGZ_A_SPRA404_2
(MACROLIDE
2'-PHOSPHOTRANSFERAS
E II)
2oxc PROBABLE
ATP-DEPENDENT RNA
HELICASE DDX20
(Homo
sapiens)
5 / 9LEU A 250
ILE A 103
ILE A 226
GLU A 224
GLU A 212
None
1.11A21.05
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.
5IGZ_A_SPRA404_2
(MACROLIDE
2'-PHOSPHOTRANSFERAS
E II)
2rop COPPER-TRANSPORTING
ATPASE 2
(Homo
sapiens)
5 / 9LEU A  24
ILE A  42
GLU A  39
VAL A  35
GLU A  79
None
1.21A21.64
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.
5IGZ_A_SPRA404_2
(MACROLIDE
2'-PHOSPHOTRANSFERAS
E II)
2vkt CTP SYNTHASE 2
(Homo
sapiens)
5 / 9ILE A 337
ILE A 393
PHE A 395
VAL A 521
GLU A 408
None
1.48A21.66
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.
5IGZ_A_SPRA404_2
(MACROLIDE
2'-PHOSPHOTRANSFERAS
E II)
2y6e UBIQUITIN
CARBOXYL-TERMINAL
HYDROLASE 4
(Homo
sapiens)
5 / 9LEU A 320
ILE A 359
ILE A 868
PHE A 919
VAL A 917
None
1.41A21.98
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.
5IGZ_A_SPRA404_2
(MACROLIDE
2'-PHOSPHOTRANSFERAS
E II)
3e9l PRE-MRNA-PROCESSING-
SPLICING FACTOR 8
(Homo
sapiens)
5 / 9LEU A1817
ILE A1809
ILE A1906
PHE A1902
VAL A1899
None
1.41A22.26
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.
5IGZ_A_SPRA404_2
(MACROLIDE
2'-PHOSPHOTRANSFERAS
E II)
3fs1 HEPATOCYTE NUCLEAR
FACTOR 4-ALPHA
(Homo
sapiens)
5 / 9LEU A 211
ILE A 196
GLU A 201
PHE A 199
GLU A 191
None
1.18A23.60
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.
5IGZ_A_SPRA404_2
(MACROLIDE
2'-PHOSPHOTRANSFERAS
E II)
3ksy SON OF SEVENLESS
HOMOLOG 1
(Homo
sapiens)
5 / 9LEU A 788
HIS A 827
ILE A 855
GLU A 857
VAL A 861
None
0.88A13.74
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.
5IGZ_A_SPRA404_2
(MACROLIDE
2'-PHOSPHOTRANSFERAS
E II)
3tg1 DUAL SPECIFICITY
PROTEIN PHOSPHATASE
10
(Homo
sapiens)
5 / 9LEU B 256
ILE B 175
ILE B 149
GLU B 242
GLU B 265
None
1.33A18.42
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.
5IGZ_A_SPRA404_2
(MACROLIDE
2'-PHOSPHOTRANSFERAS
E II)
4f92 U5 SMALL NUCLEAR
RIBONUCLEOPROTEIN
200 KDA HELICASE
(Homo
sapiens)
5 / 9LEU B 876
HIS B 421
ILE B 870
GLU B 444
VAL B 445
None
1.45A10.52
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.
5IGZ_A_SPRA404_2
(MACROLIDE
2'-PHOSPHOTRANSFERAS
E II)
4grl MHC CLASS II
HLA-DQ-ALPHA CHAIN
(Homo
sapiens)
5 / 9LEU A  12
ILE A 112
GLU A  85
PHE A 145
GLU A  25
None
1.50A18.98
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.
5IGZ_A_SPRA404_2
(MACROLIDE
2'-PHOSPHOTRANSFERAS
E II)
4j5a PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE
F, MITOCHONDRIAL
(Homo
sapiens)
5 / 9LEU X 140
ARG X  79
GLU X 128
PHE X 171
VAL X 169
None
1.50A19.80
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.
5IGZ_A_SPRA404_2
(MACROLIDE
2'-PHOSPHOTRANSFERAS
E II)
4s15 NUCLEAR RECEPTOR
ROR-ALPHA
(Homo
sapiens)
5 / 9LEU A 356
ILE A 341
GLU A 346
PHE A 344
GLU A 336
None
1.39A21.20
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.
5IGZ_A_SPRA404_2
(MACROLIDE
2'-PHOSPHOTRANSFERAS
E II)
4ydh FORMIN-LIKE PROTEIN
1
(Homo
sapiens)
5 / 9LEU A 261
GLU A 298
PHE A 296
VAL A 299
GLU A 311
None
1.21A22.93
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.
5IGZ_A_SPRA404_2
(MACROLIDE
2'-PHOSPHOTRANSFERAS
E II)
5avi OXYSTEROLS RECEPTOR
LXR-ALPHA
(Homo
sapiens)
5 / 9LEU A 414
ILE A 339
GLU A 341
PHE A 342
GLU A 301
None
4KM  A 501 ( 4.0A)
None
None
None
1.49A21.36
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.
5IGZ_A_SPRA404_2
(MACROLIDE
2'-PHOSPHOTRANSFERAS
E II)
5o1p ALPHA-AMINOADIPIC
SEMIALDEHYDE
SYNTHASE,
MITOCHONDRIAL
(Homo
sapiens)
5 / 9HIS A 853
ILE A 616
GLU A 621
VAL A 622
GLU A 627
None
1.39A20.87