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.
6H7U_A_FVTA501_0
(PEPTIDE ABC
TRANSPORTER PERMEASE)
1ccz PROTEIN (CD58)
(Homo
sapiens)
4 / 6VAL A  26
ASN A  81
PRO A  80
ILE A  82
None
1.04A15.95
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.
6H7U_A_FVTA501_0
(PEPTIDE ABC
TRANSPORTER PERMEASE)
1jeq KU70
(Homo
sapiens)
4 / 6VAL A  97
ASN A  95
ASN A 101
ILE A 102
None
1.14A21.67
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.
6H7U_A_FVTA501_0
(PEPTIDE ABC
TRANSPORTER PERMEASE)
1orf GRANZYME A
(Homo
sapiens)
4 / 6VAL A 227
ASN A 179
ILE A 229
GLU A 100
None
1.06A17.95
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.
6H7U_A_FVTA501_0
(PEPTIDE ABC
TRANSPORTER PERMEASE)
1zd1 SULFOTRANSFERASE 4A1
(Homo
sapiens)
4 / 6VAL A 179
ASN A 134
PRO A 135
GLU A 197
None
1.24A20.12
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.
6H7U_A_FVTA501_0
(PEPTIDE ABC
TRANSPORTER PERMEASE)
3zyj LEUCINE-RICH
REPEAT-CONTAINING
PROTEIN 4C
NETRIN-G1
(Homo
sapiens;
Homo
sapiens)
4 / 6VAL A  63
ASN A  82
ASN B  89
GLU A 130
None
1.24A22.79
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.
6H7U_A_FVTA501_0
(PEPTIDE ABC
TRANSPORTER PERMEASE)
4asi ACETYL-COA
CARBOXYLASE 1
(Homo
sapiens)
4 / 6VAL A2117
ASN A2082
PRO A2120
ILE A2119
None
1.12A20.10
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.
6H7U_A_FVTA501_0
(PEPTIDE ABC
TRANSPORTER PERMEASE)
5gs0 TOLL-LIKE RECEPTOR 3
(Homo
sapiens)
4 / 6VAL A 581
ASN A 550
PRO A 554
ILE A 555
None
1.13A22.49
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.
6H7U_A_FVTA501_0
(PEPTIDE ABC
TRANSPORTER PERMEASE)
5xtb NADH-UBIQUINONE
OXIDOREDUCTASE 75
KDA SUBUNIT,
MITOCHONDRIAL
(Homo
sapiens)
4 / 6VAL M 436
ASN M 406
PRO M 407
GLU M 217
None
1.14A22.65
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.
6HZP_A_FVTA501_0
(PEPTIDE ABC
TRANSPORTER PERMEASE)
1a3q PROTEIN (NUCLEAR
FACTOR KAPPA-B P52)
(Homo
sapiens)
4 / 8VAL A  96
GLN A  45
PRO A 216
ILE A 217
None
0.92A18.47
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.
6HZP_A_FVTA501_0
(PEPTIDE ABC
TRANSPORTER PERMEASE)
2dnw ACYL CARRIER PROTEIN
(Homo
sapiens)
4 / 8VAL A  23
GLN A  52
PRO A  78
ILE A  81
None
1.07A11.82
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.
6HZP_A_FVTA501_0
(PEPTIDE ABC
TRANSPORTER PERMEASE)
3cem GLYCOGEN
PHOSPHORYLASE, LIVER
FORM
(Homo
sapiens)
4 / 8VAL A 781
GLN A 566
ILE A 689
GLU A 664
None
0.95A21.59
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.
6HZP_A_FVTA501_0
(PEPTIDE ABC
TRANSPORTER PERMEASE)
4l27 CYSTATHIONINE
BETA-SYNTHASE
(Homo
sapiens)
4 / 8VAL B 118
ASN B 113
GLN B 243
GLU B 239
None
1.10A22.83
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.
6HZP_A_FVTA501_0
(PEPTIDE ABC
TRANSPORTER PERMEASE)
5hmp UNCONVENTIONAL
MYOSIN-VC
(Homo
sapiens)
4 / 8VAL A 341
GLN A 371
ASN A 375
PRO A 388
None
1.03A21.60
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.
6HZP_A_FVTA501_0
(PEPTIDE ABC
TRANSPORTER PERMEASE)
5una 7SK SNRNA
METHYLPHOSPHATE
CAPPING ENZYME
(Homo
sapiens)
4 / 8VAL A 561
ASN A 559
GLN A 414
ILE A 475
SAH  A 701 (-4.7A)
SAH  A 701 (-3.6A)
None
SAH  A 701 (-3.8A)
1.09A21.38