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.
5BYJ_A_OQRA302_0
(SULFOTRANSFERASE)		2fho SPLICEOSOMAL PROTEIN
P14
(Homo
sapiens)		5 / 12PHE B  39
ILE B  48
GLY B  51
LEU B  26
THR B  59
None
1.14A18.18
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.
5BYJ_A_OQRA302_0
(SULFOTRANSFERASE)		2xmr PROTEIN NDRG2
(Homo
sapiens)		5 / 12PHE A  81
ILE A  78
LEU A  52
PHE A  69
THR A  53
None
1.14A22.82
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.
5BYJ_A_OQRA302_0
(SULFOTRANSFERASE)		3kbh ANGIOTENSIN-CONVERTI
NG ENZYME 2
(Homo
sapiens)		5 / 12ILE A 407
VAL A 574
GLY A 551
MET A 557
LEU A 558
None
0.82A16.86
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.
5BYJ_A_OQRA302_0
(SULFOTRANSFERASE)		3lqv PRE-MRNA BRANCH SITE
PROTEIN P14
(Homo
sapiens)		5 / 12PHE A  39
ILE A  48
GLY A  51
LEU A  26
THR A  59
None
0.98A18.15
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.
5BYJ_A_OQRA302_0
(SULFOTRANSFERASE)		3rjo ENDOPLASMIC
RETICULUM
AMINOPEPTIDASE 1
(Homo
sapiens)		5 / 12PHE A 864
ILE A 871
GLY A 877
LEU A 836
THR A 837
None
1.05A21.73
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.
5BYJ_A_OQRA302_0
(SULFOTRANSFERASE)		3thw DNA MISMATCH REPAIR
PROTEIN MSH3
(Homo
sapiens)		5 / 12MET B 883
ILE B 885
VAL B 900
GLY B 892
THR B 873
None
1.02A14.11
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.
5BYJ_A_OQRA302_0
(SULFOTRANSFERASE)		5epg ALDEHYDE OXIDASE
(Homo
sapiens)		5 / 12LEU A  31
VAL A  54
GLY A 146
THR A  40
MET A 352
None
1.06A10.69
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.
5BYJ_A_OQRA302_0
(SULFOTRANSFERASE)		5i7p PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE
FKBP1A,FKBP-TYPE
PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE
SLYD,PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE
FKBP1A
(Escherichia
coli;
Homo
sapiens)		5 / 12PHE A 146
ILE A  76
VAL A  55
GLY A  83
LEU A 139
None
1.12A21.27
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.
5BYJ_A_OQRA302_0
(SULFOTRANSFERASE)		5i7q PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE
FKBP1A,FKBP-TYPE 16
KDA PEPTIDYL-PROLYL
CIS-TRANS
ISOMERASE,PEPTIDYL-P
ROLYL CIS-TRANS
ISOMERASE FKBP1A
(Escherichia
coli;
Homo
sapiens)		5 / 12PHE A 147
ILE A  76
VAL A  55
GLY A  83
LEU A 140
None
1.07A21.54
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.
5BYJ_A_OQRA302_0
(SULFOTRANSFERASE)		5k1c WD REPEAT-CONTAINING
PROTEIN 20
(Homo
sapiens)		5 / 12HIS C 303
LEU C 536
THR C 548
LEU C 526
THR C  19
None
1.17A19.29
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.
5BYJ_A_OQRA302_0
(SULFOTRANSFERASE)		5nfb GALECTIN-3
(Homo
sapiens)		5 / 12PHE A 198
ILE A 200
GLY A 235
PHE A 159
LEU A 242
None
0.96A22.69
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.
5BYJ_A_OQRA302_0
(SULFOTRANSFERASE)		5o2c SERINE/THREONINE-PRO
TEIN KINASE WNK3
(Homo
sapiens)		5 / 12ILE A 206
GLY A 296
PHE A 209
THR A 227
LEU A 276
None
GOL  A 603 (-3.6A)
None
GOL  A 604 (-3.9A)
None
1.16A20.85
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.
5BYJ_A_OQRA302_0
(SULFOTRANSFERASE)		5oik TRANSCRIPTION
ELONGATION FACTOR
SPT5
(Homo
sapiens)		5 / 12HIS Z 572
ILE Z 550
GLY Z 633
LEU Z 506
THR Z 507
None
1.05A12.93
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.
5BYJ_A_OQRA302_0
(SULFOTRANSFERASE)		5oik TRANSCRIPTION
ELONGATION FACTOR
SPT5
(Homo
sapiens)		5 / 12ILE Z 550
GLY Z 633
THR Z 569
LEU Z 506
THR Z 507
None
1.14A12.93
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.
5TIX_A_OQRA302_0
(SULFOTRANSFERASE)		1nst HEPARAN SULFATE
N-DEACETYLASE/N-SULF
OTRANSFERASE
(Homo
sapiens)		5 / 9PRO A 871
VAL A 775
LEU A 776
ILE A 773
PHE A 681
None
1.35A21.39
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.
5TIX_A_OQRA302_0
(SULFOTRANSFERASE)		4xat NOELIN
(Homo
sapiens)		5 / 9PRO A 253
MET A 250
VAL A 359
LEU A 364
ASP A 356
None
None
None
None
CA  A 501 ( 2.7A)
1.27A20.54
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.
5TIX_B_OQRB302_0
(SULFOTRANSFERASE)		2he3 GLUTATHIONE
PEROXIDASE 2
(Homo
sapiens)		5 / 10LEU A 119
VAL A  31
LEU A  32
PHE A  66
GLU A  34
None
1.47A22.61
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.
5TIX_B_OQRB302_0
(SULFOTRANSFERASE)		2mki CYTOPLASMIC
POLYADENYLATION
ELEMENT-BINDING
PROTEIN 4
(Homo
sapiens)		5 / 10PRO A  73
ILE A 151
LEU A  72
VAL A 139
PHE A  85
None
1.31A20.97
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.
5TIX_B_OQRB302_0
(SULFOTRANSFERASE)		3h5c PROTEIN Z-DEPENDENT
PROTEASE INHIBITOR
(Homo
sapiens)		5 / 10PRO A  81
ILE A 367
LEU A 411
LEU A  66
PHE A 401
None
1.24A20.78
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.
5TIX_B_OQRB302_0
(SULFOTRANSFERASE)		3ihp UBIQUITIN
CARBOXYL-TERMINAL
HYDROLASE 5
(Homo
sapiens)		5 / 10MET A 446
LEU A 443
VAL A 377
LEU A 380
ASP A 372
None
1.24A13.74
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.
5TIX_B_OQRB302_0
(SULFOTRANSFERASE)		3lfv CGMP-SPECIFIC
3',5'-CYCLIC
PHOSPHODIESTERASE
(Homo
sapiens)		5 / 10PRO A 270
ILE A 266
VAL A 233
LEU A 236
ASP A 248
None
1.26A20.95
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.
5TIX_B_OQRB302_0
(SULFOTRANSFERASE)		3qxm GLUTAMATE RECEPTOR
IONOTROPIC, KAINATE
2
(Homo
sapiens)		5 / 10ILE A 433
LEU A 439
VAL A 404
LEU A 402
SER A 440
None
1.47A22.50
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.
5TIX_B_OQRB302_0
(SULFOTRANSFERASE)		3r92 HEAT SHOCK PROTEIN
HSP 90-ALPHA
(Homo
sapiens)		5 / 10MET A  30
ILE A  26
PHE A  22
SER A 164
GLU A 163
None
1.31A22.59
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.
5TIX_B_OQRB302_0
(SULFOTRANSFERASE)		3v4v INTEGRIN BETA-7
(Homo
sapiens)		5 / 10PRO B 106
LEU B 447
VAL B  86
LEU B  87
GLU B 450
None
1.42A17.55
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.
5TIX_B_OQRB302_0
(SULFOTRANSFERASE)		4f52 E3 UBIQUITIN-PROTEIN
LIGASE RBX1
GLOMULIN
(Homo
sapiens;
Homo
sapiens)		5 / 10MET E 472
ILE E 568
VAL E 575
LEU E 578
GLU B  55
None
1.46A18.23
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.
5TIX_B_OQRB302_0
(SULFOTRANSFERASE)		4qik ROQUIN-1
(Homo
sapiens)		5 / 10LEU A 161
VAL A 387
LEU A 391
PHE A 330
GLU A 168
None
1.34A22.66
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.
5TIX_B_OQRB302_0
(SULFOTRANSFERASE)		4xat NOELIN
(Homo
sapiens)		5 / 10PRO A 253
MET A 250
VAL A 359
LEU A 364
ASP A 356
None
None
None
None
CA  A 501 ( 2.7A)
1.29A20.54
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.
5TIX_B_OQRB302_0
(SULFOTRANSFERASE)		4z31 ROQUIN-2
(Homo
sapiens)		5 / 10LEU A 158
VAL A 384
LEU A 388
PHE A 327
GLU A 165
None
1.39A24.29
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.
5TIX_B_OQRB302_0
(SULFOTRANSFERASE)		5ftg CHOLINE KINASE ALPHA
(Homo
sapiens)		5 / 10ILE A 343
LEU A 219
LEU A 326
PHE A 378
SER A 225
None
EDO  A1459 (-4.5A)
None
None
None
1.46A21.61
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.
5TIX_B_OQRB302_0
(SULFOTRANSFERASE)		5gl7 METHIONINE--TRNA
LIGASE, CYTOPLASMIC
(Homo
sapiens)		5 / 10PRO A 433
ILE A 425
VAL A 401
LEU A 396
ASP A 416
None
1.40A17.89
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.
5TIX_B_OQRB302_0
(SULFOTRANSFERASE)		5uan RETINOIC ACID
RECEPTOR BETA
(Homo
sapiens)		5 / 10PRO B 401
MET B 399
ILE B 395
SER B 222
GLU B 223
None
1.46A20.65