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.
6AJI_A_AY6A1001_0
(DRUG EXPORTERS OF
THE RND
SUPERFAMILY-LIKE
PROTEIN,ENDOLYSIN)		1u6g TIP120 PROTEIN
(Homo
sapiens)		5 / 12ILE C 799
ILE C 739
LEU C 776
ALA C 805
LEU C 806
None
0.80A22.27
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.
6AJI_A_AY6A1001_0
(DRUG EXPORTERS OF
THE RND
SUPERFAMILY-LIKE
PROTEIN,ENDOLYSIN)		1yzg ADP-RIBOSYLATION
FACTOR-LIKE 8
(Homo
sapiens)		5 / 12VAL A  91
ILE A  88
ILE A 122
PHE A  12
ALA A 159
None
None
None
None
GDP  A 181 (-3.3A)
1.00A11.93
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.
6AJI_A_AY6A1001_0
(DRUG EXPORTERS OF
THE RND
SUPERFAMILY-LIKE
PROTEIN,ENDOLYSIN)		2adc POLYPYRIMIDINE
TRACT-BINDING
PROTEIN 1
(Homo
sapiens)		5 / 12ILE A 449
VAL A 360
LEU A 357
VAL A 501
LEU A 508
None
0.80A12.80
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.
6AJI_A_AY6A1001_0
(DRUG EXPORTERS OF
THE RND
SUPERFAMILY-LIKE
PROTEIN,ENDOLYSIN)		2jak SERINE/THREONINE-PRO
TEIN PHOSPHATASE 2A
56 KDA REGULATORY
SUBUNIT GAMMA
ISOFORM
(Homo
sapiens)		5 / 12VAL A 286
ILE A 311
VAL A 271
LEU A 267
TYR A 263
None
1.05A17.33
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.
6AJI_A_AY6A1001_0
(DRUG EXPORTERS OF
THE RND
SUPERFAMILY-LIKE
PROTEIN,ENDOLYSIN)		2odt INOSITOL-TETRAKISPHO
SPHATE 1-KINASE
(Homo
sapiens)		5 / 12ILE X 113
LEU X 103
LEU X 269
ALA X 272
LEU X 273
None
1.18A15.30
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.
6AJI_A_AY6A1001_0
(DRUG EXPORTERS OF
THE RND
SUPERFAMILY-LIKE
PROTEIN,ENDOLYSIN)		3pyc E3 UBIQUITIN-PROTEIN
LIGASE SMURF1
(Homo
sapiens)		5 / 12VAL A  98
ILE A  40
ILE A 133
LEU A  68
LEU A 137
None
0.95A9.76
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.
6AJI_A_AY6A1001_0
(DRUG EXPORTERS OF
THE RND
SUPERFAMILY-LIKE
PROTEIN,ENDOLYSIN)		4eut SERINE/THREONINE-PRO
TEIN KINASE TBK1
(Homo
sapiens)		5 / 12ILE A 207
ILE A 141
VAL A 115
LEU A 116
PHE A 299
None
0.84A17.74
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.
6AJI_A_AY6A1001_0
(DRUG EXPORTERS OF
THE RND
SUPERFAMILY-LIKE
PROTEIN,ENDOLYSIN)		4fdd TRANSPORTIN-1
(Homo
sapiens)		5 / 12ILE A 444
LEU A 485
LEU A 462
ALA A 466
LEU A 507
None
0.81A22.96
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.
6AJI_A_AY6A1001_0
(DRUG EXPORTERS OF
THE RND
SUPERFAMILY-LIKE
PROTEIN,ENDOLYSIN)		4m0p RIBOSE-PHOSPHATE
PYROPHOSPHOKINASE 1
(Homo
sapiens)		5 / 12LEU A 218
ILE A 247
VAL A 178
VAL A 244
ALA A 216
None
1.20A16.72
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.
6AJI_A_AY6A1001_0
(DRUG EXPORTERS OF
THE RND
SUPERFAMILY-LIKE
PROTEIN,ENDOLYSIN)		4mk0 BETA-ADRENERGIC
RECEPTOR KINASE 1
(Homo
sapiens)		5 / 12VAL A 180
ILE A  32
VAL A 521
LEU A  67
LEU A  63
None
1.05A20.29
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.
6AJI_A_AY6A1001_0
(DRUG EXPORTERS OF
THE RND
SUPERFAMILY-LIKE
PROTEIN,ENDOLYSIN)		4oya ADENYLATE CYCLASE
TYPE 10
(Homo
sapiens)		5 / 12ILE A 145
ILE A  82
VAL A  86
LEU A 147
VAL A 175
None
1.16A19.44
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.
6AJI_A_AY6A1001_0
(DRUG EXPORTERS OF
THE RND
SUPERFAMILY-LIKE
PROTEIN,ENDOLYSIN)		5h64 SERINE/THREONINE-PRO
TEIN KINASE MTOR
(Homo
sapiens)		5 / 12LEU A2209
ILE A2222
LEU A2201
PHE A2358
VAL A2403
None
1.12A17.04
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.
6AJI_A_AY6A1001_0
(DRUG EXPORTERS OF
THE RND
SUPERFAMILY-LIKE
PROTEIN,ENDOLYSIN)		5uuu BETA-ADRENERGIC
RECEPTOR KINASE 1
(Homo
sapiens)		5 / 12VAL A 180
ILE A  32
VAL A 521
LEU A  67
LEU A  63
None
0.97A20.49
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.
6AJI_A_AY6A1001_0
(DRUG EXPORTERS OF
THE RND
SUPERFAMILY-LIKE
PROTEIN,ENDOLYSIN)		5wve APOPTOTIC
PROTEASE-ACTIVATING
FACTOR 1
(Homo
sapiens)		5 / 12LEU A 386
ILE A 388
VAL A 395
LEU A 403
LEU A 400
None
1.20A22.06