Ligand ID: TRU


Drugbank ID:
DB01021
(Trichlormethiazide)



Indication:
Used in the treatment of oedema (including that associated with heart failure) and hypertension.


Get human targets for TRU in PDB (known and potential targets)

RESULTS FROM SUB-STRUCTURAL SIMILARITY SEARCHES MAPPED TO LIGAND 'TRU' AND SARS-COV-2 / COVID-19 STRUCTURES

1) User may click on the DrReposER ID (the first 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 throuh AutoDock Vina.


DrReposER ID / Desc. Hit
PDBID
Hit
Macromolecule
Res.
Matches
View Interface RMSD Seq.
Identity (%)
HETATM 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.
1ZGF_A_TRUA300_1
(CARBONIC ANHYDRASE
II)
5rfc 3C-LIKE PROTEINASE
(SARS-CoV-2)
5 / 12
ASN A 231
HIS A 246
VAL A 261
LEU A 205
THR A 201
1.73A21.51
None
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.
1ZGF_A_TRUA300_1
(CARBONIC ANHYDRASE
II)
5rfc 3C-LIKE PROTEINASE
(SARS-CoV-2)
5 / 12
ASN A 231
HIS A 246
VAL A 247
LEU A 205
THR A 201
1.68A21.51
None
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.
1ZGF_A_TRUA300_1
(CARBONIC ANHYDRASE
II)
5rfc 3C-LIKE PROTEINASE
(SARS-CoV-2)
5 / 12
ASN A 231
HIS A 246
VAL A 261
LEU A 268
THR A 201
1.79A21.51
None
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.
1ZGF_A_TRUA300_1
(CARBONIC ANHYDRASE
II)
5rfc 3C-LIKE PROTEINASE
(SARS-CoV-2)
5 / 12
GLN A 244
VAL A 247
LEU A 262
THR A 225
THR A 226
1.73A21.51
None
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.
1ZGF_A_TRUA300_1
(CARBONIC ANHYDRASE
II)
6lze VIRAL PROTEASE
(SARS-CoV-2)
5 / 12
ASN A 231
HIS A 246
VAL A 247
LEU A 205
THR A 201
1.61A23.05
None
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.
1ZGF_A_TRUA300_1
(CARBONIC ANHYDRASE
II)
6lze VIRAL PROTEASE
(SARS-CoV-2)
5 / 12
ASN A 231
HIS A 246
VAL A 261
LEU A 205
THR A 201
1.72A23.05
None
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.
1ZGF_A_TRUA300_1
(CARBONIC ANHYDRASE
II)
6m0k VIRAL PROTEASE
(SARS-CoV-2)
5 / 12
ASN A 231
HIS A 246
VAL A 247
LEU A 205
THR A 201
1.62A22.82
None
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.
1ZGF_A_TRUA300_1
(CARBONIC ANHYDRASE
II)
6m0k VIRAL PROTEASE
(SARS-CoV-2)
5 / 12
ASN A 231
HIS A 246
VAL A 261
LEU A 205
THR A 201
1.72A22.82
None
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.
1ZGF_A_TRUA300_1
(CARBONIC ANHYDRASE
II)
6m2n 3CL PROTEASE
(SARS-CoV-2)
5 / 12
ASN C 231
HIS C 246
VAL C 247
LEU C 205
THR C 201
1.58A22.99
None
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.
1ZGF_A_TRUA300_1
(CARBONIC ANHYDRASE
II)
6m2n 3CL PROTEASE
(SARS-CoV-2)
5 / 12
ASN A 231
HIS A 246
VAL A 261
LEU A 205
THR A 201
1.74A22.99
None
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.
1ZGF_A_TRUA300_1
(CARBONIC ANHYDRASE
II)
6m2n 3CL PROTEASE
(SARS-CoV-2)
5 / 12
ASN C 231
HIS C 246
VAL C 261
LEU C 205
THR C 201
1.72A22.99
None
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.
1ZGF_A_TRUA300_1
(CARBONIC ANHYDRASE
II)
6m2n 3CL PROTEASE
(SARS-CoV-2)
5 / 12
GLN D 244
VAL D 247
LEU D 262
THR D 225
THR D 226
1.76A22.99
None
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.
1ZGF_A_TRUA300_1
(CARBONIC ANHYDRASE
II)
6m2n 3CL PROTEASE
(SARS-CoV-2)
5 / 12
GLN C 244
VAL C 247
LEU C 262
THR C 225
THR C 226
1.67A22.99
None
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.
1ZGF_A_TRUA300_1
(CARBONIC ANHYDRASE
II)
6m2n 3CL PROTEASE
(SARS-CoV-2)
5 / 12
ASN A 231
HIS A 246
VAL A 247
LEU A 205
THR A 201
1.60A22.99
None
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.
1ZGF_A_TRUA300_1
(CARBONIC ANHYDRASE
II)
6m2n 3CL PROTEASE
(SARS-CoV-2)
5 / 12
ASN B 231
HIS B 246
VAL B 247
LEU B 205
THR B 201
1.63A22.99
None
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.
3ILT_H_TRUH800_1
(GLUTAMATE RECEPTOR 2)
6m2n 3CL PROTEASE
(SARS-CoV-2)
3 / 3
ILE B 152
SER D 123
SER D 121
1.77A22.05
None
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.
1ZGF_A_TRUA300_1
(CARBONIC ANHYDRASE
II)
6m2n 3CL PROTEASE
(SARS-CoV-2)
5 / 12
ASN B 231
HIS B 246
VAL B 261
LEU B 205
THR B 201
1.76A22.99
None
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.
1ZGF_A_TRUA300_1
(CARBONIC ANHYDRASE
II)
6m2n 3CL PROTEASE
(SARS-CoV-2)
5 / 12
ASN D 231
HIS D 246
VAL D 247
LEU D 205
THR D 201
1.65A22.99
None
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.
1ZGF_A_TRUA300_1
(CARBONIC ANHYDRASE
II)
6m2q 3CL PROTEASE
(SARS-CoV-2)
5 / 12
ASN A 231
HIS A 246
VAL A 247
LEU A 205
THR A 201
1.70A22.99
None
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.
1ZGF_A_TRUA300_1
(CARBONIC ANHYDRASE
II)
6m2q 3CL PROTEASE
(SARS-CoV-2)
5 / 12
ASN A 231
HIS A 246
VAL A 261
LEU A 205
THR A 201
1.73A22.99
None
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.
3ILT_H_TRUH800_1
(GLUTAMATE RECEPTOR 2)
6m71 NSP12
(SARS-CoV-2)
3 / 3
ILE A 450
SER A 672
SER A 397
1.75A14.89
None
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.
3ILT_H_TRUH800_1
(GLUTAMATE RECEPTOR 2)
6m71 NSP7
(SARS-CoV-2)
3 / 3
ILE C  68
SER C  61
SER C  57
1.40A15.16
None
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.
1ZGF_A_TRUA300_1
(CARBONIC ANHYDRASE
II)
6vsb SPIKE GLYCOPROTEIN
(SARS-CoV-2)
5 / 12
ASN B 317
GLN B 314
LEU C 861
THR C 734
THR C 859
1.42A11.12
None
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.
1ZGF_A_TRUA300_1
(CARBONIC ANHYDRASE
II)
6vyb SPIKE GLYCOPROTEIN
(SARS-CoV-2)
5 / 12
ASN B 317
GLN B 314
LEU C 861
THR C 734
THR C 859
1.52A11.62
None
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.
3ILT_B_TRUB800_1
(GLUTAMATE RECEPTOR 2)
6vyb SPIKE GLYCOPROTEIN
(SARS-CoV-2)
5 / 12
LEU C1049
LYS C1028
ILE C 909
SER C1037
LYS C1038
1.69A12.62
None
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.
3ILT_H_TRUH800_1
(GLUTAMATE RECEPTOR 2)
6vyb SPIKE GLYCOPROTEIN
(SARS-CoV-2)
3 / 3
ILE C 670
SER C 659
SER C 698
1.11A12.62
None
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.
1ZGF_A_TRUA300_1
(CARBONIC ANHYDRASE
II)
6w63 3C-LIKE PROTEINASE
(SARS-CoV-2)
5 / 12
ASN A 231
HIS A 246
VAL A 247
LEU A 205
THR A 201
1.65A22.99
None
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.
1ZGF_A_TRUA300_1
(CARBONIC ANHYDRASE
II)
6w63 3C-LIKE PROTEINASE
(SARS-CoV-2)
5 / 12
ASN A 231
HIS A 246
VAL A 261
LEU A 205
THR A 201
1.76A22.99
None
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.
3ILT_H_TRUH800_1
(GLUTAMATE RECEPTOR 2)
6w75 NSP16
(SARS-CoV-2)
3 / 3
ILE C6910
SER C6903
SER C6907
1.72A20.46
None
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.
3ILT_H_TRUH800_1
(GLUTAMATE RECEPTOR 2)
6w75 NSP16
(SARS-CoV-2)
3 / 3
ILE A7035
SER A6998
SER A6831
1.60A20.46
None
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.
3ILT_H_TRUH800_1
(GLUTAMATE RECEPTOR 2)
6w75 NSP16
(SARS-CoV-2)
3 / 3
ILE C7035
SER C6998
SER C6831
1.53A20.46
None
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.
3ILT_H_TRUH800_1
(GLUTAMATE RECEPTOR 2)
6w75 NSP16
(SARS-CoV-2)
3 / 3
ILE C7088
SER C7090
SER A7089
1.63A20.46
None
NA  C7104 ( 2.5A)
None
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.
3ILT_H_TRUH800_1
(GLUTAMATE RECEPTOR 2)
6wjt 2'-O-METHYLTRANSFERA
SE
(SARS-CoV-2)
3 / 3
ILE C7088
SER C7090
SER A7089
1.59A20.13
None
FMT  C7107 (-2.7A)
None
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.
3ILT_H_TRUH800_1
(GLUTAMATE RECEPTOR 2)
6wjt 2'-O-METHYLTRANSFERA
SE
(SARS-CoV-2)
3 / 3
ILE A7035
SER A6998
SER A6831
1.61A20.13
None
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.
3ILT_H_TRUH800_1
(GLUTAMATE RECEPTOR 2)
6wjt 2'-O-METHYLTRANSFERA
SE
(SARS-CoV-2)
3 / 3
ILE C6910
SER C6903
SER C6907
1.74A20.13
None
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.
3ILT_H_TRUH800_1
(GLUTAMATE RECEPTOR 2)
6wkq NSP16
(SARS-CoV-2)
3 / 3
ILE C7088
SER C7090
SER A7089
1.60A20.13
None
NA  C7102 ( 2.7A)
None
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.
3ILT_H_TRUH800_1
(GLUTAMATE RECEPTOR 2)
6wkq NSP16
(SARS-CoV-2)
3 / 3
ILE C6910
SER C6903
SER C6907
1.73A20.13
None
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.
1ZGF_A_TRUA300_1
(CARBONIC ANHYDRASE
II)
6wnp 3C-LIKE PROTEINASE
(SARS-CoV-2)
5 / 12
ASN A 231
HIS A 246
VAL A 247
LEU A 205
THR A 201
1.61A22.99
None
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.
1ZGF_A_TRUA300_1
(CARBONIC ANHYDRASE
II)
6wnp 3C-LIKE PROTEINASE
(SARS-CoV-2)
5 / 12
ASN A 231
HIS A 246
VAL A 261
LEU A 205
THR A 201
1.72A22.99
None
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.
1ZGF_A_TRUA300_1
(CARBONIC ANHYDRASE
II)
6woj REPLICASE
POLYPROTEIN 1AB
(SARS-CoV-2)
5 / 12
ASN A 159
HIS D 119
VAL D  34
VAL D  36
THR D 149
1.75A21.77
None
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.
1ZGF_A_TRUA300_1
(CARBONIC ANHYDRASE
II)
6woj REPLICASE
POLYPROTEIN 1AB
(SARS-CoV-2)
5 / 12
ASN C 159
HIS B 119
VAL B  34
VAL B  36
THR B 149
1.75A21.77
None
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.
1ZGF_A_TRUA300_1
(CARBONIC ANHYDRASE
II)
6wqf 3C-LIKE PROTEINASE
(SARS-CoV-2)
5 / 12
ASN A 231
HIS A 246
VAL A 247
LEU A 205
THR A 201
1.72A22.99
None
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.
1ZGF_A_TRUA300_1
(CARBONIC ANHYDRASE
II)
6wrh PEPTIDASE C16
(SARS-CoV-2)
5 / 12
GLN A  30
HIS A  50
VAL A  21
VAL A   7
THR A  34
1.69A19.77
None
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.
1ZGF_A_TRUA300_1
(CARBONIC ANHYDRASE
II)
6y2g REPLICASE
POLYPROTEIN 1AB
(SARS-CoV-2)
5 / 12
ASN B 231
HIS B 246
VAL B 247
LEU B 205
THR B 201
1.59A22.99
None
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.
1ZGF_A_TRUA300_1
(CARBONIC ANHYDRASE
II)
6yb7 REPLICASE
POLYPROTEIN 1AB
(SARS-CoV-2)
5 / 12
ASN A 231
HIS A 246
VAL A 261
LEU A 205
THR A 201
1.74A21.89
None
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.
1ZGF_A_TRUA300_1
(CARBONIC ANHYDRASE
II)
6yb7 REPLICASE
POLYPROTEIN 1AB
(SARS-CoV-2)
5 / 12
ASN A 231
HIS A 246
VAL A 247
LEU A 205
THR A 201
1.70A21.89
None
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.
1ZGF_A_TRUA300_1
(CARBONIC ANHYDRASE
II)
6yb7 REPLICASE
POLYPROTEIN 1AB
(SARS-CoV-2)
5 / 12
GLN A 244
VAL A 247
LEU A 262
THR A 225
THR A 226
1.75A21.89
None
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.
3ILT_B_TRUB800_1
(GLUTAMATE RECEPTOR 2)
6yhu REPLICASE
POLYPROTEIN 1A
(SARS-CoV-2)
5 / 12
MET A  62
SER A  61
LEU A  71
LEU A  59
SER A  57
1.67A13.39
None
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.
3ILT_E_TRUE800_1
(GLUTAMATE RECEPTOR 2)
6yhu REPLICASE
POLYPROTEIN 1A
(SARS-CoV-2)
5 / 10
SER A  57
MET A  62
SER A  61
LEU A  71
LEU A  59
1.66A13.39
None
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.
3ILT_H_TRUH800_1
(GLUTAMATE RECEPTOR 2)
6yla SPIKE GLYCOPROTEIN
(SARS-CoV-2)
3 / 3
ILE E 434
SER E 373
SER E 375
1.78A19.35
None
DMS  E 901 (-3.2A)
None
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.
1ZGF_A_TRUA300_1
(CARBONIC ANHYDRASE
II)
6ynq REPLICASE
POLYPROTEIN 1AB
(SARS-CoV-2)
5 / 12
ASN A 231
HIS A 246
VAL A 247
LEU A 205
THR A 201
1.75A22.69
None
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.
1ZGF_A_TRUA300_1
(CARBONIC ANHYDRASE
II)
6ynq REPLICASE
POLYPROTEIN 1AB
(SARS-CoV-2)
5 / 12
GLN A 244
VAL A 247
LEU A 262
THR A 225
THR A 226
1.74A22.69
None
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.
3ILT_H_TRUH800_1
(GLUTAMATE RECEPTOR 2)
6yor SPIKE GLYCOPROTEIN
(SARS-CoV-2)
3 / 3
ILE E 434
SER E 373
SER E 375
1.79A22.18
None
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.
3ILT_H_TRUH800_1
(GLUTAMATE RECEPTOR 2)
6yor SPIKE GLYCOPROTEIN
(SARS-CoV-2)
3 / 3
ILE A 434
SER A 373
SER A 375
1.78A22.18
None
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.
1ZGF_A_TRUA300_1
(CARBONIC ANHYDRASE
II)
6yt8 REPLICASE
POLYPROTEIN 1AB
(SARS-CoV-2)
5 / 12
ASN A 231
HIS A 246
VAL A 261
LEU A 205
THR A 201
1.77A22.69
None
PEG  A 405 (-3.2A)
None
None
None
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.
1ZGF_A_TRUA300_1
(CARBONIC ANHYDRASE
II)
6yt8 REPLICASE
POLYPROTEIN 1AB
(SARS-CoV-2)
5 / 12
ASN A 231
HIS A 246
VAL A 247
LEU A 205
THR A 201
1.70A22.69
None
PEG  A 405 (-3.2A)
None
None
None
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.
3ILT_H_TRUH800_1
(GLUTAMATE RECEPTOR 2)
6ywl NSP3 MACRODOMAIN
(SARS-CoV-2)
3 / 3
ILE A 106
SER A 128
SER A 139
1.26A20.08
EDO  A 204 ( 4.0A)
APR  A 201 (-4.4A)
None
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.
3ILT_H_TRUH800_1
(GLUTAMATE RECEPTOR 2)
6ywm NSP3 MACRODOMAIN
(SARS-CoV-2)
3 / 3
ILE A 106
SER A 128
SER A 139
1.31A20.08
EDO  A 205 ( 4.3A)
MES  A 201 (-4.4A)
None
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.
1ZGF_A_TRUA300_1
(CARBONIC ANHYDRASE
II)
7bqy MAIN PROTEASE
(SARS-CoV-2)
5 / 12
ASN A 231
HIS A 246
VAL A 247
LEU A 205
THR A 201
1.57A22.99
None
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.
1ZGF_A_TRUA300_1
(CARBONIC ANHYDRASE
II)
7bqy MAIN PROTEASE
(SARS-CoV-2)
5 / 12
ASN A 231
HIS A 246
VAL A 261
LEU A 205
THR A 201
1.73A22.99
None
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.
1ZGF_A_TRUA300_1
(CARBONIC ANHYDRASE
II)
7btf NSP12
NSP8
(SARS-CoV-2)
5 / 12
ASN B 118
VAL A 330
VAL A 341
THR B 124
THR B 123
1.71A20.96
None
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.
1ZGF_A_TRUA300_1
(CARBONIC ANHYDRASE
II)
7buy VIRUS MAIN PROTEASE
(SARS-CoV-2)
5 / 12
ASN A 231
HIS A 246
VAL A 261
LEU A 205
THR A 201
1.75A22.99
None
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.
1ZGF_A_TRUA300_1
(CARBONIC ANHYDRASE
II)
7buy VIRUS MAIN PROTEASE
(SARS-CoV-2)
5 / 12
ASN A 231
HIS A 246
VAL A 247
LEU A 205
THR A 201
1.64A22.99
None
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.
1ZGF_A_TRUA300_1
(CARBONIC ANHYDRASE
II)
7buy VIRUS MAIN PROTEASE
(SARS-CoV-2)
5 / 12
GLN A 244
VAL A 247
VAL A 261
THR A 225
THR A 226
1.62A22.99
None
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.
3ILT_E_TRUE800_1
(GLUTAMATE RECEPTOR 2)
7bv1 NSP12
NSP7
(SARS-CoV-2)
5 / 10
PRO A 412
SER C  15
LEU C  40
SER C  10
LEU C  55
1.74A14.87
None
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.
3ILT_B_TRUB800_1
(GLUTAMATE RECEPTOR 2)
7bv1 NSP12
NSP7
(SARS-CoV-2)
5 / 12
PRO A 412
SER C  15
LEU C  40
SER C  10
LEU C  55
1.72A14.87
None
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.
3ILT_B_TRUB800_1
(GLUTAMATE RECEPTOR 2)
7bv1 NSP7
NSP8
(SARS-CoV-2)
5 / 12
SER C  61
LEU D  95
LEU C  55
ILE D 107
SER C  57
1.77A15.79
None
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.
3ILT_E_TRUE800_1
(GLUTAMATE RECEPTOR 2)
7bv1 NSP7
NSP8
(SARS-CoV-2)
5 / 10
ILE D 107
SER C  57
SER C  61
LEU D  95
LEU C  55
1.75A18.87
None