Ligand ID: OBN


Drugbank ID:
DB01092
(Ouabain)



Indication:
For the treatment of atrial fibrillation and flutter and heart failure


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

RESULTS FROM SUB-STRUCTURAL SIMILARITY SEARCHES MAPPED TO LIGAND 'OBN' AND SARS-RELATED PROTEINS ONLY

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.
1IBG_H_OBNH1_1
(IGG2B-KAPPA 40-50
FAB (HEAVY CHAIN))
1uj1 3C-LIKE PROTEINASE
(SARSr-CoV)
4 / 6
HIS B 172
LEU B 141
TYR B 182
VAL B 171
1.71A22.73
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.
3A3Y_A_OBNA6000_1
(NA, K-ATPASE ALPHA
SUBUNIT)
1uk3 3C-LIKE PROTEINASE
(SARSr-CoV)
5 / 10
GLU A  47
GLY A  23
VAL A  20
LEU A  58
ARG A  60
1.79A14.85
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.
1IBG_H_OBNH1_2
(IGG2B-KAPPA 40-50
FAB (HEAVY CHAIN)
IGG2B-KAPPA 40-50
FAB (LIGHT CHAIN))
1uk4 3C-LIKE PROTEINASE
5-MER PEPTIDE OF
INHIBITOR
(SARSr-CoV)
4 / 7
THR G   3
SER G   2
HIS A  41
LEU A  86
1.54A3.74
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.
1IBG_H_OBNH1_2
(IGG2B-KAPPA 40-50
FAB (HEAVY CHAIN)
IGG2B-KAPPA 40-50
FAB (LIGHT CHAIN))
1uk4 3C-LIKE PROTEINASE
(SARSr-CoV)
4 / 7
THR B 257
SER B 254
SER B 301
LEU A 141
1.52A20.77
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.
3N23_A_OBNA1_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
1wnc E2 GLYCOPROTEIN
(SARSr-CoV)
5 / 11
GLN B 904
ASN B 907
ALA A 912
PHE C 909
ILE B 916
1.79A8.38
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.
4HYT_A_OBNA1104_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
1wnc E2 GLYCOPROTEIN
(SARSr-CoV)
5 / 12
GLN E1161
LEU E 930
GLU E1162
LEU E1167
ARG E1166
1.27A8.38
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.
4XE5_A_OBNA1104_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
1wnc E2 GLYCOPROTEIN
(SARSr-CoV)
5 / 12
GLU F1169
GLU F1162
GLY F 928
ALA F 926
GLU D1162
1.57A8.48
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.
4HYT_A_OBNA1104_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
1wyy E2 GLYCOPROTEIN
(SARSr-CoV)
5 / 12
GLN B1161
GLY A 928
ALA A 926
THR A 921
ARG A1166
1.31A10.71
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.
3N23_A_OBNA1_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
1wyy E2 GLYCOPROTEIN
(SARSr-CoV)
5 / 11
GLN A 931
ASP B1165
ASN B1168
ILE B1160
ARG A1166
1.75A11.24
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.
4HYT_A_OBNA1104_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
1x7q BETA-2-MICROGLOBULIN
HLA, A-11
(Homo
sapiens)
5 / 12
GLN A  32
LEU B  65
GLY A 239
ALA A 236
PHE A 241
1.48A14.30
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.
4XE5_A_OBNA1104_2
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
1x7q BETA-2-MICROGLOBULIN
HLA, A-11
(Homo
sapiens)
4 / 6
PRO A  50
VAL A  28
THR A 178
ARG B  12
1.44A13.52
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.
3N23_A_OBNA1_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
1x7q HLA, A-11
(Homo
sapiens)
5 / 11
GLN A  43
ASP A  37
VAL A  25
PHE A  22
ARG A  75
1.69A14.40
None
None
None
None
SO4  A4002 (-3.9A)
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.
3N23_C_OBNC1_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
1x7q HLA, A-11
(Homo
sapiens)
5 / 11
GLN A  43
ASP A  37
VAL A  25
PHE A  22
ARG A  75
1.69A14.40
None
None
None
None
SO4  A4002 (-3.9A)
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.
4HYT_C_OBNC2004_2
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
1z1j 3C-LIKE PROTEINASE
(SARSr-CoV)
4 / 4
PRO B1132
ASP B1197
ASN B1133
ILE B1136
1.66A13.48
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.
3N23_A_OBNA1_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
1z1j 3C-LIKE PROTEINASE
(SARSr-CoV)
5 / 11
ASP A 197
VAL A 171
PHE A 185
THR A 135
ILE A 136
1.78A13.37
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.
4HYT_A_OBNA1104_2
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
1z1j 3C-LIKE PROTEINASE
(SARSr-CoV)
4 / 5
PRO B1132
ASP B1197
ASN B1133
ILE B1136
1.66A13.48
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.
3N23_C_OBNC1_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
2a5k 3C-LIKE PEPTIDASE
(SARSr-CoV)
5 / 11
ASN B 231
LEU B 227
VAL B 247
THR B 243
ARG B 131
1.77A13.65
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.
1IBG_H_OBNH1_1
(IGG2B-KAPPA 40-50
FAB (HEAVY CHAIN))
2a5k 3C-LIKE PEPTIDASE
(SARSr-CoV)
4 / 6
LEU A 282
PHE A   3
TYR B 126
VAL A 296
1.73A22.36
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.
4XE5_A_OBNA1104_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
2acf REPLICASE
POLYPROTEIN 1AB
(SARS-COV
Tor2)
5 / 12
GLN A 244
GLU A 246
LEU A 235
ALA A 238
ASP D 352
1.64A10.42
GOL  A1002 (-4.2A)
None
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.
4XE5_A_OBNA1104_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
2ahm REPLICASE
POLYPROTEIN 1AB,
HEAVY CHAIN
(SARSr-CoV)
5 / 12
GLN H  29
GLU H  28
LEU H  40
GLY H  34
GLU H  37
1.65A12.52
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.
3N23_C_OBNC1_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
2ahm REPLICASE
POLYPROTEIN 1AB,
HEAVY CHAIN
(SARSr-CoV)
5 / 11
PRO E 126
ASN E 123
LEU E 122
VAL E 136
PHE E 152
1.75A12.89
GOL  E2001 (-4.4A)
GOL  E2004 (-4.5A)
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.
3N23_C_OBNC1_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
2ajf ACE2
(Homo
sapiens)
5 / 11
GLN A 531
LEU A 554
VAL A 404
ALA A 403
ARG A 582
1.54A20.48
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.
4HYT_A_OBNA1104_2
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
2amd 3C-LIKE PROTEINASE
(SARSr-CoV)
4 / 5
PRO A 132
ASP A 197
ASN A 133
ILE A 136
1.68A13.77
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.
4HYT_C_OBNC2004_2
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
2amd 3C-LIKE PROTEINASE
(SARSr-CoV)
4 / 4
PRO A 132
ASP A 197
ASN A 133
ILE A 136
1.68A13.77
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.
3N23_C_OBNC1_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
2amq 3C-LIKE PROTEINASE
(SARSr-CoV)
5 / 11
GLN A 273
LEU A 205
VAL A 261
ALA A 260
PHE A 223
1.52A13.89
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.
4XE5_A_OBNA1104_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
2beq SPIKE GLYCOPROTEIN
(SARSr-CoV)
5 / 12
GLN F1183
GLU F1184
ASP F1181
LEU E1179
ILE A 916
1.63A3.83
None
None
ACE  B 913 ( 3.7A)
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.
3A3Y_A_OBNA6000_1
(NA, K-ATPASE ALPHA
SUBUNIT)
2cjr NUCLEOCAPSID PROTEIN
(SARS-COV
TW1)
5 / 10
PHE E 315
GLY E 317
VAL F 271
PHE E 316
LEU F 354
1.61A7.82
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.
1IBG_H_OBNH1_2
(IGG2B-KAPPA 40-50
FAB (HEAVY CHAIN)
IGG2B-KAPPA 40-50
FAB (LIGHT CHAIN))
2cme HYPOTHETICAL PROTEIN
5
(SARSr-CoV)
4 / 7
THR B  96
SER A  54
ARG B  48
LEU B  82
1.44A19.90
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.
4HYT_A_OBNA1104_2
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
2cme HYPOTHETICAL PROTEIN
5
(SARSr-CoV)
4 / 5
PRO H  18
ASP H  17
ILE G  24
VAL H  76
1.72A6.11
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.
1IBG_H_OBNH1_2
(IGG2B-KAPPA 40-50
FAB (HEAVY CHAIN)
IGG2B-KAPPA 40-50
FAB (LIGHT CHAIN))
2cme HYPOTHETICAL PROTEIN
5
(SARSr-CoV)
4 / 7
THR G  96
SER H  54
ARG G  48
LEU G  88
1.55A18.91
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.
1IBG_H_OBNH1_2
(IGG2B-KAPPA 40-50
FAB (HEAVY CHAIN)
IGG2B-KAPPA 40-50
FAB (LIGHT CHAIN))
2cme HYPOTHETICAL PROTEIN
5
(SARSr-CoV)
4 / 7
THR D  96
SER C  54
ARG D  48
LEU D  82
1.25A18.32
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.
1IBG_H_OBNH1_2
(IGG2B-KAPPA 40-50
FAB (HEAVY CHAIN)
IGG2B-KAPPA 40-50
FAB (LIGHT CHAIN))
2cme HYPOTHETICAL PROTEIN
5
(SARSr-CoV)
4 / 7
THR A  96
SER B  54
ARG A  48
LEU A  82
1.58A19.40
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.
1IBG_H_OBNH1_1
(IGG2B-KAPPA 40-50
FAB (HEAVY CHAIN))
2d2d 3C-LIKE PROTEINASE
(SARSr-CoV)
4 / 6
LEU A 282
PHE A   3
TYR B 126
VAL A 296
1.66A22.68
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.
3N23_C_OBNC1_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
2dd8 IGG HEAVY CHAIN
IGG LIGHT CHAIN
(Homo
sapiens)
5 / 11
PRO L 120
LEU H 141
ALA L 128
PHE L 126
THR L 132
1.78A12.66
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.
3N23_C_OBNC1_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
2dd8 SPIKE GLYCOPROTEIN
(SARSr-CoV)
5 / 11
LEU S 421
VAL S 497
ALA S 384
PHE S 501
PHE S 379
1.73A12.26
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.
1IBG_H_OBNH1_2
(IGG2B-KAPPA 40-50
FAB (HEAVY CHAIN)
IGG2B-KAPPA 40-50
FAB (LIGHT CHAIN))
2fe8 REPLICASE
POLYPROTEIN 1AB
(SARSr-CoV)
4 / 7
SER A 156
SER A  79
TYR A  36
LEU A  59
1.23A20.06
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.
4HYT_A_OBNA1104_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
2fe8 REPLICASE
POLYPROTEIN 1AB
(SARSr-CoV)
5 / 12
GLY A  39
ALA A  40
LEU B  76
THR A  35
ARG A  83
1.44A15.43
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.
3A3Y_A_OBNA6000_1
(NA, K-ATPASE ALPHA
SUBUNIT)
2fe8 REPLICASE
POLYPROTEIN 1AB
(SARSr-CoV)
5 / 10
GLU B  78
GLY B  33
LEU B  65
THR B  10
ARG B  66
1.44A14.40
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.
4XE5_A_OBNA1104_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
2ghw ANTI-SCFV ANTIBODY,
80R
(Homo
sapiens)
5 / 12
GLN D  39
GLU D  46
GLY D 233
ALA D 141
GLU D 237
1.41A12.39
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.
3A3Y_A_OBNA6000_1
(NA, K-ATPASE ALPHA
SUBUNIT)
2ghw ANTI-SCFV ANTIBODY,
80R
SPIKE GLYCOPROTEIN
(Homo
sapiens;
SARSr-CoV)
5 / 10
GLY D 196
ALA D 183
PHE C 460
LEU C 443
THR D 185
1.52A12.10
None
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1IBG_H_OBNH1_1
(IGG2B-KAPPA 40-50
FAB (HEAVY CHAIN))
2ghw ANTI-SCFV ANTIBODY,
80R
(Homo
sapiens)
4 / 6
HIS B  35
LEU B 104
TRP B 107
VAL B  50
1.60A39.04
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.
1IBG_H_OBNH1_2
(IGG2B-KAPPA 40-50
FAB (HEAVY CHAIN)
IGG2B-KAPPA 40-50
FAB (LIGHT CHAIN))
2ghw ANTI-SCFV ANTIBODY,
80R
(Homo
sapiens)
4 / 7
SER B  31
SER B  56
ARG B  72
TYR B  59
1.55A27.31
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.
4HYT_A_OBNA1104_2
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
2gri NSP3
(SARSr)
4 / 5
ASP A  33
ASN A  37
ILE A  24
VAL A  62
1.40A7.07
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.
4HYT_A_OBNA1104_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
2h85 PUTATIVE ORF1AB
POLYPROTEIN
(SARSr-CoV)
5 / 12
GLU A 233
GLY A 253
ALA A 255
PHE A 213
PHE A 221
1.28A15.96
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.
3A3Y_A_OBNA6000_1
(NA, K-ATPASE ALPHA
SUBUNIT)
2h85 PUTATIVE ORF1AB
POLYPROTEIN
(SARSr-CoV)
5 / 10
GLY A 140
ALA A 137
PHE A 134
PHE A 179
LEU A 151
1.68A16.23
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.
1IBG_H_OBNH1_2
(IGG2B-KAPPA 40-50
FAB (HEAVY CHAIN)
IGG2B-KAPPA 40-50
FAB (LIGHT CHAIN))
2h85 PUTATIVE ORF1AB
POLYPROTEIN
(SARSr-CoV)
4 / 7
THR A 340
HIS A 249
SER A 293
LEU A 345
1.51A20.06
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.
3A3Y_A_OBNA6000_1
(NA, K-ATPASE ALPHA
SUBUNIT)
2hsx LEADER PROTEIN
P65 HOMOLOG
NSP1
(SARSr-CoV)
5 / 10
GLU A  80
PHE A  59
GLY A  94
VAL A   9
LEU A  53
1.78A9.08
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.
4HYT_A_OBNA1104_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
2jw8 NUCLEOCAPSID PROTEIN
(SARSr-CoV)
5 / 12
GLU B 281
GLY A 317
ALA A 314
ILE A 338
ARG B 277
1.36A7.97
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.
3A3Y_A_OBNA6000_1
(NA, K-ATPASE ALPHA
SUBUNIT)
2jzd REPLICASE
POLYPROTEIN 1AB
(SARSr-CoV)
5 / 10
GLU A 571
ALA A 540
PHE A 581
LEU A 596
THR A 605
1.48A8.93
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.
3N23_C_OBNC1_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
2k7x REPLICASE
POLYPROTEIN 1AB MAIN
PROTEASE
(SARS-COV
Sino1-11)
5 / 11
GLN A 273
LEU A 205
VAL A 261
ALA A 260
PHE A 223
1.72A8.68
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.
3N23_A_OBNA1_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
2k87 NSP3 OF REPLICASE
POLYPROTEIN 1A
(SARSr-CoV)
5 / 11
ASP A  35
VAL A  86
ALA A  64
PHE A  54
THR A  93
1.76A7.56
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.
1IBG_H_OBNH1_1
(IGG2B-KAPPA 40-50
FAB (HEAVY CHAIN))
2kaf NSP3
(SARSr-CoV)
4 / 6
HIS A  42
PHE A  32
TYR A  16
VAL A  30
1.74A16.22
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.
4XE5_A_OBNA1104_2
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
2kaf NSP3
(SARSr-CoV)
4 / 6
PRO A  47
VAL A  56
PHE A  50
THR A  43
1.54A5.18
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.
3A3Y_A_OBNA6000_1
(NA, K-ATPASE ALPHA
SUBUNIT)
2kqv NSP3
(SARSr-CoV)
5 / 10
GLU A  49
ALA A  18
PHE A  59
LEU A  74
THR A  83
1.70A11.41
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.
4XE5_A_OBNA1104_2
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
2kqv NSP3
(SARSr-CoV)
4 / 6
PRO A  66
ILE A  71
THR A  90
ARG A 100
1.58A11.56
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.
1IBG_H_OBNH1_1
(IGG2B-KAPPA 40-50
FAB (HEAVY CHAIN))
2kqw NSP3
(SARSr-CoV)
4 / 6
HIS A 173
PHE A 163
TYR A 147
VAL A 161
1.74A21.93
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.
4HYT_A_OBNA1104_2
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
2op9 REPLICASE
POLYPROTEIN 1AB
(PP1AB, ORF1AB)
3C-LIKE PROTEINASE
(3CL-PRO, 3CLP)
(SARSr-CoV)
4 / 5
PRO A 132
ASP A 197
ASN A 133
ILE A 136
1.69A14.60
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.
4HYT_C_OBNC2004_2
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
2op9 REPLICASE
POLYPROTEIN 1AB
(PP1AB, ORF1AB)
3C-LIKE PROTEINASE
(3CL-PRO, 3CLP)
(SARSr-CoV)
4 / 4
PRO A 132
ASP A 197
ASN A 133
ILE A 136
1.68A14.60
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.
1IBG_H_OBNH1_1
(IGG2B-KAPPA 40-50
FAB (HEAVY CHAIN))
2op9 REPLICASE
POLYPROTEIN 1AB
(PP1AB, ORF1AB)
3C-LIKE PROTEINASE
(3CL-PRO, 3CLP)
(SARSr-CoV)
4 / 6
LEU B 282
PHE B   3
TYR A 126
VAL B 296
1.77A21.90
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.
1IBG_H_OBNH1_2
(IGG2B-KAPPA 40-50
FAB (HEAVY CHAIN)
IGG2B-KAPPA 40-50
FAB (LIGHT CHAIN))
2op9 REPLICASE
POLYPROTEIN 1AB
(PP1AB, ORF1AB)
3C-LIKE PROTEINASE
(3CL-PRO, 3CLP)
(SARSr-CoV)
4 / 7
THR A 257
SER A 254
SER A 301
LEU B 141
1.63A21.34
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.
3N23_C_OBNC1_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
2op9 REPLICASE
POLYPROTEIN 1AB
(PP1AB, ORF1AB)
3C-LIKE PROTEINASE
(3CL-PRO, 3CLP)
(SARSr-CoV)
5 / 11
GLN B 273
LEU B 205
VAL B 261
ALA B 260
PHE B 223
1.56A14.52
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.
3A3Y_A_OBNA6000_1
(NA, K-ATPASE ALPHA
SUBUNIT)
2ozk URIDYLATE-SPECIFIC
ENDORIBONUCLEASE
(SARSr-CoV)
5 / 10
GLY D 140
ALA D 137
PHE D 134
PHE D 179
LEU D 151
1.67A16.32
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.
4HYT_A_OBNA1104_2
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
2ozk URIDYLATE-SPECIFIC
ENDORIBONUCLEASE
(SARSr-CoV)
4 / 5
ASP A 124
ASN A  62
ILE A  85
VAL A 162
1.57A16.41
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.
4HYT_A_OBNA1104_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
2ozk URIDYLATE-SPECIFIC
ENDORIBONUCLEASE
(SARSr-CoV)
5 / 12
GLY D 140
ALA D 137
PHE D 134
PHE D 179
LEU D 151
1.48A16.41
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.
3N23_C_OBNC1_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
2q6g REPLICASE
POLYPROTEIN 1AB
(SARS-COV
BJ01)
5 / 11
PRO A 122
VAL B 125
ALA A   7
PHE A 150
PHE A 159
1.72A13.94
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.
3N23_A_OBNA1_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
2q6g REPLICASE
POLYPROTEIN 1AB
(SARS-COV
BJ01)
5 / 11
PRO A 122
VAL B 125
ALA A   7
PHE A 150
PHE A 159
1.72A13.94
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.
1IBG_H_OBNH1_1
(IGG2B-KAPPA 40-50
FAB (HEAVY CHAIN))
2q6g REPLICASE
POLYPROTEIN 1AB
(SARS-COV
BJ01)
4 / 6
LEU A 282
PHE A   3
TYR B 126
VAL A 296
1.79A22.73
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.
3N23_C_OBNC1_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
2qc2 3C-LIKE PROTEINASE
(-)
5 / 11
PRO B 122
VAL A 125
ALA B   7
PHE B 150
PHE B 159
1.75A13.27
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.
3A3Y_A_OBNA6000_1
(NA, K-ATPASE ALPHA
SUBUNIT)
2qc2 3C-LIKE PROTEINASE
(-)
5 / 10
PHE A 291
VAL A 212
ALA A 211
PHE A   3
LEU B 141
1.67A14.95
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.
1IBG_H_OBNH1_2
(IGG2B-KAPPA 40-50
FAB (HEAVY CHAIN)
IGG2B-KAPPA 40-50
FAB (LIGHT CHAIN))
2qc2 3C-LIKE PROTEINASE
(-)
4 / 7
THR B 257
SER B 254
SER B 301
LEU A 141
1.58A20.77
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.
3N23_A_OBNA1_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
2qc2 3C-LIKE PROTEINASE
(-)
5 / 11
PRO B 122
VAL A 125
ALA B   7
PHE B 150
PHE B 159
1.75A13.27
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.
1IBG_H_OBNH1_1
(IGG2B-KAPPA 40-50
FAB (HEAVY CHAIN))
2qc2 3C-LIKE PROTEINASE
(-)
4 / 6
LEU A 282
PHE A   3
TYR B 126
VAL A 296
1.66A22.36
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.
1IBG_H_OBNH1_2
(IGG2B-KAPPA 40-50
FAB (HEAVY CHAIN)
IGG2B-KAPPA 40-50
FAB (LIGHT CHAIN))
2qcy 3C-LIKE PROTEINASE
(SARSr-CoV)
4 / 7
THR A 190
ARG A 188
TYR A  54
LEU A  57
1.61A20.77
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.
4HYT_A_OBNA1104_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
2rhb URIDYLATE-SPECIFIC
ENDORIBONUCLEASE
(SARSr-CoV)
5 / 12
GLU C 233
GLY C 253
ALA C 255
PHE C 213
PHE C 221
1.30A16.29
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.
3A3Y_A_OBNA6000_1
(NA, K-ATPASE ALPHA
SUBUNIT)
2rhb URIDYLATE-SPECIFIC
ENDORIBONUCLEASE
(SARSr-CoV)
5 / 10
GLU A 233
GLY A 253
ALA A 255
PHE A 213
PHE A 221
1.54A16.05
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.
4HYT_A_OBNA1104_2
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
2rhb URIDYLATE-SPECIFIC
ENDORIBONUCLEASE
(SARSr-CoV)
4 / 5
PRO A  50
ASN A  52
ILE A  26
VAL A   5
1.78A16.29
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.
1IBG_H_OBNH1_2
(IGG2B-KAPPA 40-50
FAB (HEAVY CHAIN)
IGG2B-KAPPA 40-50
FAB (LIGHT CHAIN))
2rhb URIDYLATE-SPECIFIC
ENDORIBONUCLEASE
(SARSr-CoV)
4 / 7
THR E 285
SER F 171
ARG E 257
LEU E 200
1.51A19.45
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.
1IBG_H_OBNH1_1
(IGG2B-KAPPA 40-50
FAB (HEAVY CHAIN))
2w2g NSP3
(SARSr-CoV)
4 / 6
LEU B 412
PHE B 414
TYR B 487
VAL B 457
1.77A20.79
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.
3A3Y_A_OBNA6000_1
(NA, K-ATPASE ALPHA
SUBUNIT)
2wct NSP3
(SARSr-CoV)
5 / 10
GLU C 619
VAL C 632
ALA C 631
LEU C 648
THR C 528
1.71A13.89
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.
1IBG_H_OBNH1_2
(IGG2B-KAPPA 40-50
FAB (HEAVY CHAIN)
IGG2B-KAPPA 40-50
FAB (LIGHT CHAIN))
2xyq PUTATIVE 2'-O-METHYL
TRANSFERASE
(SARSr-CoV)
4 / 7
THR A  82
HIS A  69
SER A 129
LEU A 153
1.63A22.00
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.
4XE5_A_OBNA1104_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
2xyq PUTATIVE 2'-O-METHYL
TRANSFERASE
(SARSr-CoV)
5 / 12
GLU A 203
LEU A 239
GLY A  31
ILE A  36
ASP A 130
1.56A13.65
None
None
None
None
SAH  A1293 (-3.7A)
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.
1IBG_H_OBNH1_2
(IGG2B-KAPPA 40-50
FAB (HEAVY CHAIN)
IGG2B-KAPPA 40-50
FAB (LIGHT CHAIN))
2xyr PUTATIVE 2'-O-METHYL
TRANSFERASE
(SARSr-CoV)
4 / 7
THR A  82
HIS A  69
SER A 129
LEU A 153
1.64A22.00
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.
4XE5_A_OBNA1104_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
2xyr PUTATIVE 2'-O-METHYL
TRANSFERASE
(SARSr-CoV)
5 / 12
GLU A 203
LEU A 239
GLY A  31
ILE A  36
ASP A 130
1.56A13.62
None
None
None
None
SFG  A1298 (-3.6A)
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.
3N23_A_OBNA1_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
2z9g 3C-LIKE PROTEINASE
(SARSr-CoV)
5 / 11
GLN A 110
ASP A 289
ASN A 203
ALA A 234
THR A 199
1.47A13.77
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.
3N23_C_OBNC1_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
3atw 3C-LIKE PROTEINASE
(SARSr-CoV)
5 / 11
ASN B 231
LEU B 227
VAL B 247
THR B 243
ARG B 131
1.79A13.91
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.
4XE5_A_OBNA1104_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
3aw0 3C-LIKE PROTEINASE
PEPTIDE
ACE-SER-ALA-VAL-LEU-
HIS-H
(SARSr-CoV)
5 / 12
ASP A 187
LEU B   5
GLU A 178
GLY A 174
ALA A 173
1.52A14.50
None
HSV  B   6 ( 4.4A)
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.
3N23_A_OBNA1_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
3bgf F26G19 FAB
(Mus
musculus)
5 / 11
ASN L 138
ALA L 196
PHE L 118
THR L 114
ILE L 205
1.60A11.44
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.
4XE5_A_OBNA1104_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
3bgf F26G19 FAB
(Mus
musculus)
5 / 12
GLN B  99
GLU B  95
GLY C  31
ALA C  51
ILE C  48
1.45A12.41
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.
4HYT_A_OBNA1104_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
3bgf F26G19 FAB
SPIKE PROTEIN S1
(Mus
musculus;
SARSr-CoV)
5 / 12
GLN L  90
GLU L  28
GLY S 488
LEU H 100
THR H 100
1.51A11.44
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.
1IBG_H_OBNH1_2
(IGG2B-KAPPA 40-50
FAB (HEAVY CHAIN)
IGG2B-KAPPA 40-50
FAB (LIGHT CHAIN))
3bgf F26G19 FAB
SPIKE PROTEIN S1
(Mus
musculus;
SARSr-CoV)
4 / 7
THR S 359
SER S 358
SER H  76
TYR H  79
1.45A24.03
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.
4HYT_A_OBNA1104_2
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
3d0g ACE2
(Paguma
larvata;
Homo
sapiens;
SARSr-CoV)
4 / 5
ASP B 295
ASN B 290
ILE B 291
VAL B 283
1.45A20.10
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.
4XE5_A_OBNA1104_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
3d0g ACE2
(Paguma
larvata;
Homo
sapiens;
SARSr-CoV)
5 / 12
GLU A 536
LEU B 418
GLU B 536
ALA B 412
ILE B 421
1.38A19.98
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.
3N23_C_OBNC1_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
3d0g ACE2
(Paguma
larvata;
Homo
sapiens;
SARSr-CoV)
5 / 11
GLN A 531
LEU A 554
VAL A 404
ALA A 403
ARG A 582
1.73A20.48
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.
4HYT_A_OBNA1104_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
3d0g ACE2
(Paguma
larvata;
Homo
sapiens;
SARSr-CoV)
5 / 12
GLU A 536
LEU B 418
GLU B 536
ALA B 412
ILE B 421
1.32A20.10
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.
3A3Y_A_OBNA6000_1
(NA, K-ATPASE ALPHA
SUBUNIT)
3d0h ACE2
(Paguma
larvata;
Homo
sapiens;
SARSr-CoV)
5 / 10
GLY B 272
VAL B 487
PHE B 452
PHE B 512
LEU B 456
1.76A18.98
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.
1IBG_H_OBNH1_2
(IGG2B-KAPPA 40-50
FAB (HEAVY CHAIN)
IGG2B-KAPPA 40-50
FAB (LIGHT CHAIN))
3d62 3C-LIKE PROTEINASE
(SARSr-CoV)
4 / 7
THR A 243
HIS A 246
TYR A 239
LEU A 268
1.61A21.54
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.
3N23_C_OBNC1_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
3e91 3C-LIKE PROTEINASE
(SARSr-CoV)
5 / 11
GLN A 273
LEU A 205
VAL A 261
ALA A 260
PHE A 223
1.70A14.02
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.
1IBG_H_OBNH1_2
(IGG2B-KAPPA 40-50
FAB (HEAVY CHAIN)
IGG2B-KAPPA 40-50
FAB (LIGHT CHAIN))
3e91 3C-LIKE PROTEINASE
(SARSr-CoV)
4 / 7
SER B 113
SER B 139
TYR B 118
LEU B 141
1.62A21.27
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.
1IBG_H_OBNH1_1
(IGG2B-KAPPA 40-50
FAB (HEAVY CHAIN))
3ea7 3C-LIKE PROTEINASE
(SARSr-CoV)
4 / 6
LEU A 282
PHE A   3
TYR B 126
VAL A 296
1.71A22.08
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.
3N23_A_OBNA1_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
3ea8 3C-LIKE PROTEINASE
(SARSr-CoV)
5 / 11
PRO A 293
ASN A 203
ALA A 284
PHE A   3
ILE A 281
1.73A14.02
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.
4XE5_A_OBNA1104_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
3eaj 3C-LIKE PROTEINASE
(SARSr-CoV)
5 / 12
GLN B 107
GLY B 109
ALA B 129
ILE B 136
ASP A 248
1.30A14.50
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.
3N23_A_OBNA1_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
3eaj 3C-LIKE PROTEINASE
(SARSr-CoV)
5 / 11
PRO B 293
ASN B 203
ALA B 284
PHE B   3
ILE B 281
1.76A14.13
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.
3N23_C_OBNC1_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
3ebn REPLICASE
POLYPROTEIN 1AB
(SARSr-CoV)
5 / 11
GLN D 273
LEU B 205
VAL D 261
ALA D 260
ARG B 222
1.41A8.47
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.
1IBG_H_OBNH1_2
(IGG2B-KAPPA 40-50
FAB (HEAVY CHAIN)
IGG2B-KAPPA 40-50
FAB (LIGHT CHAIN))
3f9g 3C-LIKE PROTEINASE
(SARSr-CoV)
4 / 7
THR A 243
HIS A 246
TYR A 239
LEU A 268
1.62A21.27
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.
1IBG_H_OBNH1_1
(IGG2B-KAPPA 40-50
FAB (HEAVY CHAIN))
3f9g 3C-LIKE PROTEINASE
(SARSr-CoV)
4 / 6
LEU A 282
PHE A   3
TYR B 126
VAL A 296
1.73A21.27
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.
3N23_A_OBNA1_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
3f9h 3C-LIKE PROTEINASE
(SARSr-CoV)
5 / 11
PRO A 122
VAL B 125
ALA A   7
PHE A 150
PHE A 159
1.79A13.86
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.
3N23_C_OBNC1_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
3f9h 3C-LIKE PROTEINASE
(SARSr-CoV)
5 / 11
PRO A 122
VAL B 125
ALA A   7
PHE A 150
PHE A 159
1.79A13.86
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.
3N23_C_OBNC1_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
3i6g HLA, A-2
(Homo
sapiens)
5 / 11
GLN D  43
ASP D  37
VAL D  25
PHE D  22
ARG D  75
1.46A13.22
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.
3N23_A_OBNA1_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
3i6g HLA, A-2
(Homo
sapiens)
5 / 11
GLN D  43
ASP D  37
VAL D  25
PHE D  22
ARG D  75
1.46A13.22
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.
4HYT_A_OBNA1104_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
3i6g BETA-2-MICROGLOBULIN
HLA, A-2
(Homo
sapiens)
5 / 12
GLN D  32
LEU E  65
GLY D 239
ALA D 236
PHE D 241
1.27A13.15
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.
4HYT_A_OBNA1104_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
3i6l BETA-2-MICROGLOBULIN
HLA, A-24
(Homo
sapiens)
5 / 12
GLN D  32
LEU E  65
GLY D 239
ALA D 236
PHE D 241
1.45A14.71
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.
1IBG_H_OBNH1_2
(IGG2B-KAPPA 40-50
FAB (HEAVY CHAIN)
IGG2B-KAPPA 40-50
FAB (LIGHT CHAIN))
3m3s 3C-LIKE PROTEINASE
(SARSr-CoV)
4 / 7
THR B 190
ARG B 188
TYR B  54
LEU B  57
1.64A20.90
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.
3A3Y_A_OBNA6000_1
(NA, K-ATPASE ALPHA
SUBUNIT)
3m3s 3C-LIKE PROTEINASE
(SARSr-CoV)
5 / 10
GLU B 290
PHE B 291
VAL B 212
ALA B 214
PHE B   3
1.65A14.95
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.
3N23_A_OBNA1_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
3m3s 3C-LIKE PROTEINASE
(SARSr-CoV)
5 / 11
ASP A 197
VAL A 171
PHE A 185
THR A 135
ILE A 136
1.79A13.27
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.
3N23_A_OBNA1_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
3m3v 3C-LIKE PROTEINASE
(SARSr-CoV)
5 / 11
PRO B 122
VAL A 125
ALA B   7
PHE B 150
PHE B 159
1.77A14.01
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.
1IBG_H_OBNH1_2
(IGG2B-KAPPA 40-50
FAB (HEAVY CHAIN)
IGG2B-KAPPA 40-50
FAB (LIGHT CHAIN))
3m3v 3C-LIKE PROTEINASE
(SARSr-CoV)
4 / 7
SER B 113
SER B 139
TYR B 118
LEU B 141
1.61A21.14
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.
3N23_C_OBNC1_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
3m3v 3C-LIKE PROTEINASE
(SARSr-CoV)
5 / 11
PRO B 122
VAL A 125
ALA B   7
PHE B 150
PHE B 159
1.77A14.01
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.
1IBG_H_OBNH1_1
(IGG2B-KAPPA 40-50
FAB (HEAVY CHAIN))
3m3v 3C-LIKE PROTEINASE
(SARSr-CoV)
4 / 6
LEU A 282
PHE A   3
TYR B 126
VAL A 296
1.68A21.73
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.
1IBG_H_OBNH1_2
(IGG2B-KAPPA 40-50
FAB (HEAVY CHAIN)
IGG2B-KAPPA 40-50
FAB (LIGHT CHAIN))
3r24 2'-O-METHYL
TRANSFERASE
(SARSr-CoV)
4 / 7
THR A  82
HIS A  69
SER A 129
LEU A 153
1.61A20.69
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.
4XE5_A_OBNA1104_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
3r24 2'-O-METHYL
TRANSFERASE
(SARSr-CoV)
5 / 12
GLU A 217
LEU A 180
GLU A 276
GLY A 208
ALA A 168
1.62A15.46
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.
4HYT_C_OBNC2004_2
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
3sci ACE2
SPIKE GLYCOPROTEIN
(Homo
sapiens;
SARSr-CoV)
4 / 4
PRO E 462
ASP E 463
ASN E 473
ILE A  21
1.60A12.11
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.
4HYT_A_OBNA1104_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
3sci ACE2
(Homo
sapiens)
5 / 12
LEU A 278
GLU A 238
GLY A 448
LEU A 595
THR A 282
1.48A19.71
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.
4HYT_A_OBNA1104_2
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
3sci ACE2
(Homo
sapiens)
4 / 5
ASP B 295
ASN B 290
ILE B 291
VAL B 283
1.61A19.71
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.
4HYT_A_OBNA1104_2
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
3sci ACE2
SPIKE GLYCOPROTEIN
(Homo
sapiens;
SARSr-CoV)
4 / 5
PRO E 462
ASP E 463
ASN E 473
ILE A  21
1.60A12.11
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.
3A3Y_A_OBNA6000_1
(NA, K-ATPASE ALPHA
SUBUNIT)
3scj ACE2
(Homo
sapiens)
5 / 10
GLU B 402
ALA B 528
PHE B 525
PHE B 400
LEU B 570
1.76A19.39
ZN  B 901 (-2.5A)
None
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.
1IBG_H_OBNH1_2
(IGG2B-KAPPA 40-50
FAB (HEAVY CHAIN)
IGG2B-KAPPA 40-50
FAB (LIGHT CHAIN))
3scj ACE2
SPIKE GLYCOPROTEIN
(Homo
sapiens;
SARSr-CoV)
4 / 7
HIS B  34
ARG F 479
TYR F 475
LEU F 443
1.42A16.14
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.
4HYT_A_OBNA1104_2
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
3scl ACE2
(Paguma
larvata;
Homo
sapiens;
SARSr-CoV)
4 / 5
ASP B 295
ASN B 290
ILE B 291
VAL B 283
1.62A20.10
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.
3A3Y_A_OBNA6000_1
(NA, K-ATPASE ALPHA
SUBUNIT)
3scl ACE2
(Paguma
larvata;
Homo
sapiens;
SARSr-CoV)
5 / 10
GLY A 272
VAL A 487
PHE A 452
PHE A 512
LEU A 456
1.78A18.98
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.
3N23_C_OBNC1_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
3scl ACE2
(Paguma
larvata;
Homo
sapiens;
SARSr-CoV)
5 / 11
GLN A 531
LEU A 554
VAL A 404
ALA A 403
ARG A 582
1.43A20.48
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.
4XE5_A_OBNA1104_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
3scl ACE2
(Paguma
larvata;
Homo
sapiens;
SARSr-CoV)
5 / 12
GLU A 489
LEU A 267
GLU A 479
GLY A 486
ILE A 256
1.53A19.98
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.
3N23_C_OBNC1_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
3snd 3C-LIKE PROTEINASE
(SARSr-CoV)
5 / 11
GLN A 273
LEU A 205
VAL A 261
ALA A 260
ARG A 222
1.37A13.77
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.
4XE5_A_OBNA1104_2
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
3to2 BETA-2-MICROGLOBULIN
MHC CLASS I ANTIGEN
(Homo
sapiens)
4 / 6
PRO A  50
VAL A  28
THR A 178
ARG B  12
1.49A13.44
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.
4HYT_C_OBNC2004_2
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
3vb5 3C-LIKE PROTEINASE
(SARSr-CoV)
4 / 4
PRO A 132
ASP A 197
ASN A 133
ILE A 136
1.68A13.85
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.
4HYT_A_OBNA1104_2
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
3vb5 3C-LIKE PROTEINASE
(SARSr-CoV)
4 / 5
PRO A 132
ASP A 197
ASN A 133
ILE A 136
1.68A13.85
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.
4XE5_A_OBNA1104_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
3vb6 3C-LIKE PROTEINASE
C6Z INHIBITOR
(SARSr-CoV)
5 / 12
ASP A 187
LEU E   6
GLU A 178
GLY A 174
ALA A 173
1.49A14.24
None
0JU  E   7 ( 4.3A)
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.
4XE5_A_OBNA1104_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
4mm3 PAPAIN-LIKE
PROTEINASE
UBIQUITIN
(Homo
sapiens;
SARSr-CoV)
5 / 12
GLU B 168
ASP B 165
GLU B 204
ALA B 247
ASP A  52
1.52A15.87
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.
1IBG_H_OBNH1_2
(IGG2B-KAPPA 40-50
FAB (HEAVY CHAIN)
IGG2B-KAPPA 40-50
FAB (LIGHT CHAIN))
4ow0 PAPAIN-LIKE PROTEASE
(SARS-COV
Urbani)
4 / 7
THR B 171
HIS B 172
TYR B 113
LEU B 114
1.64A18.99
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.
1IBG_H_OBNH1_2
(IGG2B-KAPPA 40-50
FAB (HEAVY CHAIN)
IGG2B-KAPPA 40-50
FAB (LIGHT CHAIN))
5b6o 3C-LIKE PROTEINASE
(SARSr-CoV)
4 / 7
THR B 257
SER B 254
SER B 301
LEU A 141
1.46A22.39
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.
3N23_C_OBNC1_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
5b6o 3C-LIKE PROTEINASE
(SARSr-CoV)
5 / 11
ASN B 231
LEU B 227
VAL B 247
THR B 243
ARG B 131
1.79A13.81
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.
4HYT_A_OBNA1104_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
5c8s GUANINE-N7
METHYLTRANSFERASE
(SARSr-CoV)
5 / 12
LEU D 185
GLY D 110
ALA D 274
PHE D 111
LEU D 170
1.51A19.79
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.
1IBG_H_OBNH1_1
(IGG2B-KAPPA 40-50
FAB (HEAVY CHAIN))
5c8s GUANINE-N7
METHYLTRANSFERASE
(SARSr-CoV)
4 / 6
LEU B 442
PHE B 445
TYR B 491
VAL B 316
1.79A18.03
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.
4HYT_A_OBNA1104_2
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
5c8s GUANINE-N7
METHYLTRANSFERASE
(SARSr-CoV)
4 / 5
PRO B  70
ASN B 238
ILE B 201
VAL B 236
1.69A19.79
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.
4HYT_A_OBNA1104_2
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
5c8t GUANINE-N7
METHYLTRANSFERASE
(SARSr-CoV)
4 / 5
PRO D  70
ASN D 238
ILE D 201
VAL D 236
1.70A19.62
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.
4XE5_A_OBNA1104_2
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
5c8t GUANINE-N7
METHYLTRANSFERASE
NSP10
(SARSr-CoV)
4 / 6
PRO C  59
ILE D  42
VAL D  29
THR D  21
1.51A10.44
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.
4XE5_A_OBNA1104_2
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
5c8t GUANINE-N7
METHYLTRANSFERASE
(SARSr-CoV)
4 / 6
PRO B 412
ILE B 275
VAL B 115
THR B 173
1.56A20.33
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.
1IBG_H_OBNH1_1
(IGG2B-KAPPA 40-50
FAB (HEAVY CHAIN))
5c8t GUANINE-N7
METHYLTRANSFERASE
(SARSr-CoV)
4 / 6
LEU B 442
PHE B 445
TYR B 491
VAL B 316
1.80A17.80
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.
4HYT_A_OBNA1104_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
5c8u GUANINE-N7
METHYLTRANSFERASE
(SARSr-CoV)
5 / 12
LEU B 185
GLY B 110
ALA B 274
PHE B 111
LEU B 170
1.49A19.62
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.
4XE5_A_OBNA1104_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
5c8u NSP10
(SARSr-CoV)
5 / 12
GLU A  66
GLY A  70
GLU A   6
PHE A 110
ILE A  38
1.63A10.44
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.
4HYT_A_OBNA1104_2
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
5c8u GUANINE-N7
METHYLTRANSFERASE
NSP10
(SARSr-CoV)
4 / 5
PRO A  23
ASP A  22
ILE B 201
VAL B  66
1.59A10.67
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.
3A3Y_A_OBNA6000_1
(NA, K-ATPASE ALPHA
SUBUNIT)
5c8u GUANINE-N7
METHYLTRANSFERASE
(SARSr-CoV)
5 / 10
PHE D 111
ALA D 187
PHE D  89
PHE D 183
THR D 193
1.80A19.57
None
MG  D 604 (-3.4A)
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.
4HYT_A_OBNA1104_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
5nfy POLYPROTEIN 1AB
(SARS-COV
Frankfurt
1)
5 / 12
LEU B 185
GLY B 110
ALA B 274
PHE B 111
LEU B 170
1.47A19.73
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.
4HYT_A_OBNA1104_2
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
5nfy POLYPROTEIN 1AB
(SARS-COV
Frankfurt
1)
4 / 5
PRO C  70
ASN C 238
ILE C 201
VAL C 236
1.76A19.73
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.
4XE5_A_OBNA1104_2
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
5nfy POLYPROTEIN 1AB
(SARS-COV
Frankfurt
1)
4 / 6
PRO N  59
ILE B  42
VAL B  29
THR B  21
1.46A8.90
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.
4HYT_A_OBNA1104_2
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
5nfy POLYPROTEIN 1AB
(SARS-COV
Frankfurt
1)
4 / 5
PRO O  23
ASP O  22
ILE D 201
VAL D  66
1.56A8.90
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.
1IBG_H_OBNH1_1
(IGG2B-KAPPA 40-50
FAB (HEAVY CHAIN))
5nfy POLYPROTEIN 1AB
(SARS-COV
Frankfurt
1)
4 / 6
HIS D 188
LEU D 192
PHE D  73
TYR D  64
1.75A17.79
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.
3N23_C_OBNC1_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
5tl6 REPLICASE
POLYPROTEIN 1AB
UBIQUITIN-LIKE
PROTEIN ISG15
(Homo
sapiens;
SARSr-CoV)
5 / 11
GLN D 175
LEU C 131
VAL C 104
ALA C 105
ARG D  83
1.61A16.10
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.
1IBG_H_OBNH1_1
(IGG2B-KAPPA 40-50
FAB (HEAVY CHAIN))
5x4r S PROTEIN
(MERS-CoV)
4 / 6
LEU A 171
PHE A 254
TYR A 270
VAL A 118
1.69A20.94
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.
1IBG_H_OBNH1_2
(IGG2B-KAPPA 40-50
FAB (HEAVY CHAIN)
IGG2B-KAPPA 40-50
FAB (LIGHT CHAIN))
5x4r S PROTEIN
(MERS-CoV)
4 / 7
THR A 206
SER A 227
HIS A 298
TYR A 144
1.57A18.60
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.
3N23_C_OBNC1_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
5x4r S PROTEIN
(MERS-CoV)
5 / 11
LEU A  74
ALA A 113
PHE A 116
PHE A 147
THR A 257
1.53A15.83
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.
3A3Y_A_OBNA6000_1
(NA, K-ATPASE ALPHA
SUBUNIT)
5x4r S PROTEIN
(MERS-CoV)
5 / 10
PHE A 228
VAL A  19
PHE A 183
LEU A 169
THR A 238
1.68A14.86
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.
4XE5_A_OBNA1104_2
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
5x58 SPIKE GLYCOPROTEIN
(SARS-COV
BJ01)
4 / 6
PRO A 282
ILE A 637
PHE A 305
THR A 302
1.30A20.60
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.
4HYT_A_OBNA1104_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
5x58 SPIKE GLYCOPROTEIN
(SARS-COV
BJ01)
5 / 12
LEU B 959
GLY B 726
ALA B 732
LEU B 986
ILE B 979
1.38A21.53
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.
3A3Y_A_OBNA6000_1
(NA, K-ATPASE ALPHA
SUBUNIT)
5x59 S PROTEIN
(MERS-CoV)
5 / 10
PHE B 228
VAL B  19
PHE B 183
LEU B 169
THR B 238
1.67A21.58
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.
1IBG_H_OBNH1_2
(IGG2B-KAPPA 40-50
FAB (HEAVY CHAIN)
IGG2B-KAPPA 40-50
FAB (LIGHT CHAIN))
5x59 S PROTEIN
(MERS-CoV)
4 / 7
THR B 206
SER B 227
HIS B 298
TYR B 144
1.57A10.22
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.
3N23_C_OBNC1_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
5x59 S PROTEIN
(MERS-CoV)
5 / 11
GLN C 796
ASN C1029
LEU C1033
ALA C 901
PHE C 895
1.41A23.18
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.
3A3Y_A_OBNA6000_1
(NA, K-ATPASE ALPHA
SUBUNIT)
5x5b SPIKE GLYCOPROTEIN
(SARS-COV
BJ01)
5 / 10
PHE B  22
ALA B  27
PHE B  76
LEU B 235
THR B  71
1.65A21.19
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.
4XE5_A_OBNA1104_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
5x5b SPIKE GLYCOPROTEIN
(SARS-COV
BJ01)
5 / 12
LEU B 963
GLY B 726
GLU B 730
ILE B 975
ASP A 557
1.41A20.60
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.
4HYT_A_OBNA1104_2
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
5x5b SPIKE GLYCOPROTEIN
(SARS-COV
BJ01)
4 / 5
PRO A  28
ASP A  77
ILE A  81
VAL A  98
1.68A21.53
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.
1IBG_H_OBNH1_2
(IGG2B-KAPPA 40-50
FAB (HEAVY CHAIN)
IGG2B-KAPPA 40-50
FAB (LIGHT CHAIN))
5x5b SPIKE GLYCOPROTEIN
(SARS-COV
BJ01)
4 / 7
THR C 743
SER C 740
TYR B 300
LEU B 286
1.40A10.83
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.
1IBG_H_OBNH1_1
(IGG2B-KAPPA 40-50
FAB (HEAVY CHAIN))
5x5b SPIKE GLYCOPROTEIN
(SARS-COV
BJ01)
4 / 6
LEU B 170
PHE B 168
TYR B 200
VAL B 123
1.62A10.44
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.
4HYT_A_OBNA1104_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
5x5c S PROTEIN
(MERS-CoV)
5 / 12
GLN A 346
GLU B 818
GLY B 825
THR A  70
ILE A  69
1.44A23.04
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.
1IBG_H_OBNH1_1
(IGG2B-KAPPA 40-50
FAB (HEAVY CHAIN))
5x5c S PROTEIN
(MERS-CoV)
4 / 6
LEU B 171
PHE B 254
TYR B 270
VAL B 118
1.68A11.10
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.
3N23_A_OBNA1_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
5x5c S PROTEIN
(MERS-CoV)
5 / 11
GLN C 261
ASN B 475
ALA C1049
PHE B 630
ARG B 629
1.54A23.18
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.
4HYT_A_OBNA1104_2
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
5x5f S PROTEIN
(MERS-CoV)
4 / 5
ASP B 843
ASN B 839
ILE B 799
VAL B 934
1.54A23.04
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.
3A3Y_A_OBNA6000_1
(NA, K-ATPASE ALPHA
SUBUNIT)
5xlr SPIKE GLYCOPROTEIN
(SARSr-CoV)
5 / 10
GLU A 755
GLY A1041
ALA A1037
LEU A 847
ARG A 761
1.70A21.07
GLU  A 755 ( 0.6A)
GLY  A1041 ( 0.0A)
ALA  A1037 ( 0.0A)
LEU  A 847 ( 0.6A)
ARG  A 761 ( 0.6A)
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.
3N23_A_OBNA1_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
5xlr SPIKE GLYCOPROTEIN
(SARSr-CoV)
5 / 11
GLN B 835
ASP C 605
ASN C 602
PHE C 305
ILE C 610
1.79A20.74
GLN  B 835 ( 0.6A)
ASP  C 605 ( 0.5A)
ASN  C 602 ( 0.6A)
PHE  C 305 ( 1.3A)
ILE  C 610 ( 0.7A)
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.
4XE5_A_OBNA1104_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
5xlr SPIKE GLYCOPROTEIN
(SARSr-CoV)
5 / 12
GLN A 818
ASP B 554
GLY A 820
ALA A 834
ILE B 573
1.54A20.81
GLN  A 818 ( 0.6A)
ASP  B 554 ( 0.5A)
GLY  A 820 ( 0.0A)
ALA  A 834 ( 0.0A)
ILE  B 573 ( 0.6A)
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.
4XE5_A_OBNA1104_2
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
5xlr SPIKE GLYCOPROTEIN
(SARSr-CoV)
4 / 6
ILE A 570
VAL A 525
PHE A 529
THR A 517
1.16A20.81
ILE  A 570 ( 0.7A)
VAL  A 525 ( 0.6A)
PHE  A 529 ( 1.3A)
THR  A 517 ( 0.8A)
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.
4HYT_A_OBNA1104_2
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
5xlr SPIKE GLYCOPROTEIN
(SARSr-CoV)
4 / 5
ASP C1100
ASN C1101
ILE C1096
VAL A1104
1.77A20.61
ASP  C1100 ( 0.5A)
ASN  C1101 ( 0.6A)
ILE  C1096 ( 0.7A)
VAL  A1104 ( 0.6A)
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.
3A3Y_A_OBNA6000_1
(NA, K-ATPASE ALPHA
SUBUNIT)
5y3q REPLICASE
POLYPROTEIN 1A
(SARSr-CoV)
5 / 10
VAL A  42
ALA A  40
PHE A  57
LEU A  81
THR A  35
1.77A14.49
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.
3A3Y_A_OBNA6000_1
(NA, K-ATPASE ALPHA
SUBUNIT)
6acc SPIKE GLYCOPROTEIN
(SARSr-CoV)
5 / 10
PHE A1092
ALA A1060
PHE A1079
PHE A1085
THR A1082
1.73A21.07
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.
4XE5_A_OBNA1104_2
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
6acd SPIKE GLYCOPROTEIN
(SARSr-CoV)
4 / 6
ILE C 570
VAL C 525
PHE C 529
THR C 517
0.91A20.89
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.
3N23_C_OBNC1_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
6acg SPIKE GLYCOPROTEIN
(SARSr-CoV)
5 / 11
LEU B 421
VAL B 497
ALA B 384
PHE B 501
PHE B 379
1.70A20.82
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.
4HYT_A_OBNA1104_2
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
6acj SPIKE GLYCOPROTEIN
(SARSr-CoV)
4 / 5
ASP B1100
ASN B1101
ILE B1097
VAL C1104
1.65A20.69
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.
3N23_A_OBNA1_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
6acj ACE2
(Homo
sapiens)
5 / 11
PRO D 346
ASP D 368
ALA D 413
PHE D 274
ARG D 273
1.51A20.48
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.
3N23_A_OBNA1_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
6acj SPIKE GLYCOPROTEIN
(SARSr-CoV)
5 / 11
PRO A 791
ASP A 790
VAL A 860
ALA A 864
ILE A 787
1.65A20.82
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.
1IBG_H_OBNH1_2
(IGG2B-KAPPA 40-50
FAB (HEAVY CHAIN)
IGG2B-KAPPA 40-50
FAB (LIGHT CHAIN))
6acj SPIKE GLYCOPROTEIN
(SARSr-CoV)
4 / 7
THR A 743
SER A 740
TYR B 300
LEU B 286
1.29A11.07
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.
3N23_C_OBNC1_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
6acj ACE2
(Homo
sapiens)
5 / 11
PRO D 346
ASP D 368
ALA D 413
PHE D 274
ARG D 273
1.51A20.48
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.
1IBG_H_OBNH1_1
(IGG2B-KAPPA 40-50
FAB (HEAVY CHAIN))
6ack SPIKE GLYCOPROTEIN
(SARSr-CoV)
4 / 6
LEU A 859
PHE A 870
TYR B 689
VAL A1015
1.69A11.12
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.
4XE5_A_OBNA1104_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
6ack SPIKE GLYCOPROTEIN
(SARSr-CoV)
5 / 12
GLN C 895
GLU A1074
GLU C 900
GLY A1113
ILE A1097
1.58A20.89
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.
4HYT_A_OBNA1104_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
6ack SPIKE GLYCOPROTEIN
(SARSr-CoV)
5 / 12
GLU B  93
GLU B 184
GLY B  68
THR B  71
ILE B  72
1.33A20.69
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.
4XE5_A_OBNA1104_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
6crw SPIKE
GLYCOPROTEIN,FIBRITI
N
(SARSr-CoV)
5 / 12
GLU C 502
LEU C 499
GLU C 452
ALA C 384
ILE C 345
1.45A20.65
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.
4XE5_A_OBNA1104_2
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
6crw SPIKE
GLYCOPROTEIN,FIBRITI
N
(SARSr-CoV)
4 / 6
ILE C 244
PHE C 137
THR C 148
ARG C  18
1.41A20.65
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.
1IBG_H_OBNH1_2
(IGG2B-KAPPA 40-50
FAB (HEAVY CHAIN)
IGG2B-KAPPA 40-50
FAB (LIGHT CHAIN))
6crz SPIKE
GLYCOPROTEIN,FIBRITI
N
(SARSr-CoV)
4 / 7
THR C 743
SER C 740
SER C 717
LEU C 843
1.53A11.32
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.
3N23_A_OBNA1_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
6cs1 SPIKE
GLYCOPROTEIN,FIBRITI
N
(SARSr-CoV)
5 / 11
GLN C 632
PRO A 845
ALA A 765
THR A 760
ARG A 797
1.42A21.50
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.
3A3Y_A_OBNA6000_1
(NA, K-ATPASE ALPHA
SUBUNIT)
6cs1 SPIKE
GLYCOPROTEIN,FIBRITI
N
(SARSr-CoV)
5 / 10
PHE C 238
GLY C 246
VAL C  25
LEU C 235
ARG C  99
1.51A21.53
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.
4HYT_A_OBNA1104_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
6cs1 SPIKE
GLYCOPROTEIN,FIBRITI
N
(SARSr-CoV)
5 / 12
GLU B  93
GLU B 184
GLY B  68
THR B  71
ILE B  72
1.33A20.91
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.
3N23_C_OBNC1_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
6cs1 SPIKE
GLYCOPROTEIN,FIBRITI
N
(SARSr-CoV)
5 / 11
GLN C 632
PRO A 845
ALA A 765
THR A 760
ARG A 797
1.43A21.50
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.
4HYT_C_OBNC2004_2
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
6cs2 ACE2
SPIKE
GLYCOPROTEIN,FIBRITI
N
(Homo
sapiens;
SARSr-CoV)
4 / 4
PRO B 462
ASP B 463
ASN B 473
ILE D  21
1.44A20.91
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.
4HYT_A_OBNA1104_2
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
6cs2 ACE2
SPIKE
GLYCOPROTEIN,FIBRITI
N
(Homo
sapiens;
SARSr-CoV)
4 / 5
PRO B 462
ASP B 463
ASN B 473
ILE D  21
1.42A20.91
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.
1IBG_H_OBNH1_2
(IGG2B-KAPPA 40-50
FAB (HEAVY CHAIN)
IGG2B-KAPPA 40-50
FAB (LIGHT CHAIN))
6jyt HELICASE
(SARSr-CoV)
4 / 7
THR A  37
SER A  38
HIS A  33
LEU A   7
1.14A16.17
None
None
ZN  A 703 (-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.
3N23_A_OBNA1_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
6jyt HELICASE
(SARSr-CoV)
5 / 11
ASN A 489
VAL A 521
ALA A 522
PHE A 499
ILE A 525
1.66A21.79
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.
4XE5_A_OBNA1104_2
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
6jyt HELICASE
(SARSr-CoV)
4 / 6
PRO A 445
ILE A 572
VAL A 452
PHE A 587
1.47A21.83
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.
3N23_C_OBNC1_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
6jyt HELICASE
(SARSr-CoV)
5 / 11
ASP B 450
ASN B 459
VAL B 456
ALA B 403
PHE B 437
1.75A21.79
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.
4HYT_A_OBNA1104_2
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
6jyt HELICASE
(SARSr-CoV)
4 / 5
PRO A 284
ASN A 562
ILE A 448
VAL A 456
1.61A21.57
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.
3A3Y_A_OBNA6000_1
(NA, K-ATPASE ALPHA
SUBUNIT)
6jyt HELICASE
(SARSr-CoV)
5 / 10
GLU A 136
PHE A 133
VAL A  34
PHE A 106
LEU A   7
1.74A19.88
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.
4XE5_A_OBNA1104_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
6lzg ACE2
(Homo
sapiens)
5 / 12
GLU A 402
GLU A 406
LEU A 520
PHE A 274
ILE A 233
1.48A19.59
ZN  A 704 (-2.1A)
None
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.
4XE5_A_OBNA1104_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
6m0j ACE2
(Homo
sapiens)
5 / 12
GLU A 402
GLU A 406
LEU A 520
PHE A 274
ILE A 233
1.48A19.59
ZN  A 901 (-2.4A)
None
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.
1IBG_H_OBNH1_2
(IGG2B-KAPPA 40-50
FAB (HEAVY CHAIN)
IGG2B-KAPPA 40-50
FAB (LIGHT CHAIN))
6m17 ACE2
(Homo
sapiens)
4 / 7
THR D 118
SER D 113
ARG D 115
LEU D 108
1.61A15.23
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.
3A3Y_A_OBNA6000_1
(NA, K-ATPASE ALPHA
SUBUNIT)
6m17 ACE2
(Homo
sapiens)
5 / 10
GLY D 272
VAL D 487
PHE D 452
PHE D 512
LEU D 456
1.79A21.45
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.
4XE5_A_OBNA1104_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
6m17 SODIUM-DEPENDENT
NEUTRAL AMINO ACID
TRANSPORTER B(0)AT1
(Homo
sapiens)
5 / 12
GLU C  28
GLU C  25
GLY C  93
ALA C  91
ILE C 522
1.40A21.43
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.
1IBG_H_OBNH1_2
(IGG2B-KAPPA 40-50
FAB (HEAVY CHAIN)
IGG2B-KAPPA 40-50
FAB (LIGHT CHAIN))
6m18 SODIUM-DEPENDENT
NEUTRAL AMINO ACID
TRANSPORTER B(0)AT1
(Homo
sapiens)
4 / 7
THR A 131
SER A 134
SER A 483
TYR A 480
1.43A15.35
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.
3A3Y_A_OBNA6000_1
(NA, K-ATPASE ALPHA
SUBUNIT)
6m1d SODIUM-DEPENDENT
NEUTRAL AMINO ACID
TRANSPORTER B(0)AT1
(Homo
sapiens)
5 / 10
GLU C 519
VAL C 536
PHE C 514
LEU C  88
THR C 533
1.74A21.64
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.
4XE5_A_OBNA1104_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
6m1d ACE2
(Homo
sapiens)
5 / 12
GLU D 160
ASP D 157
LEU D 156
GLU D 140
ALA D 153
1.57A20.93
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.
4HYT_A_OBNA1104_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
6m1d ACE2
(Homo
sapiens)
5 / 12
GLU D 312
ALA D 412
PHE D 369
ILE D 291
ARG D 306
1.41A21.25
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.
4HYT_A_OBNA1104_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
6m1d SODIUM-DEPENDENT
NEUTRAL AMINO ACID
TRANSPORTER B(0)AT1
(Homo
sapiens)
5 / 12
GLU A  20
GLU A  25
GLY A  93
PHE A 520
LEU A  18
1.36A21.31
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.
1IBG_H_OBNH1_1
(IGG2B-KAPPA 40-50
FAB (HEAVY CHAIN))
6m1d ACE2
(Homo
sapiens)
4 / 6
LEU B 591
TRP B 594
TYR B 243
VAL B 447
1.61A13.67
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.
1IBG_H_OBNH1_2
(IGG2B-KAPPA 40-50
FAB (HEAVY CHAIN)
IGG2B-KAPPA 40-50
FAB (LIGHT CHAIN))
6nb6 SPIKE GLYCOPROTEIN
(SARSr-CoV)
4 / 7
THR A 743
SER A 740
TYR B 300
LEU B 286
1.52A10.68
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.
4XE5_A_OBNA1104_2
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
6nur NSP12
(SARSr-CoV)
4 / 6
PRO A 378
ILE A 536
VAL A 560
PHE A 506
1.45A21.02
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.
1IBG_H_OBNH1_1
(IGG2B-KAPPA 40-50
FAB (HEAVY CHAIN))
6nur NSP12
(SARSr-CoV)
4 / 6
LEU A 437
PHE A 429
TYR A 884
VAL A 424
1.63A12.27
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.
3N23_C_OBNC1_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
6nur NSP8
(SARSr-CoV)
5 / 11
ASN D 109
VAL D 132
PHE D 147
THR D 141
ARG D 190
1.62A12.82
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.
3N23_A_OBNA1_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
6nur NSP8
(SARSr-CoV)
5 / 11
ASN D 109
VAL D 132
PHE D 147
THR D 141
ARG D 190
1.62A12.82
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.
3A3Y_A_OBNA6000_1
(NA, K-ATPASE ALPHA
SUBUNIT)
6nur NSP12
NSP7
(SARSr-CoV)
5 / 10
GLU A 436
GLY A 839
VAL A 844
PHE A 440
LEU C  40
1.66A21.50
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.
1IBG_H_OBNH1_2
(IGG2B-KAPPA 40-50
FAB (HEAVY CHAIN)
IGG2B-KAPPA 40-50
FAB (LIGHT CHAIN))
6nur NSP12
(SARSr-CoV)
4 / 7
SER A 325
SER A 664
ARG A 349
LEU A 663
1.52A11.31
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.
4HYT_A_OBNA1104_2
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
6nus NSP12
(SARSr-CoV)
4 / 5
ASP A 358
ASN A 356
ILE A 536
VAL A 342
1.75A20.63
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.
3A3Y_A_OBNA6000_1
(NA, K-ATPASE ALPHA
SUBUNIT)
6vw1 ACE2
(Homo
sapiens)
5 / 10
GLY A 272
VAL A 487
PHE A 452
PHE A 512
LEU A 456
1.75A19.39
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.
3N23_C_OBNC1_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
6vw1 SPIKE GLYCOPROTEIN
(SARS-CoV-2)
5 / 11
LEU E 434
VAL E 511
ALA E 397
PHE E 515
PHE E 392
1.71A12.31
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.
4XE5_A_OBNA1104_2
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
6w41 CR3022 FAB LIGHT
CHAIN
(Homo
sapiens)
4 / 6
VAL L 115
PHE L 139
THR L 197
ARG L 142
1.77A10.05
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.
4XE5_A_OBNA1104_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
6w41 CR3022 FAB HEAVY
CHAIN
CR3022 FAB LIGHT
CHAIN
(Homo
sapiens)
5 / 12
GLN L 124
ASP L 122
ALA H 125
GLU H 212
PHE L 209
1.64A10.05
None
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1IBG_H_OBNH1_2
(IGG2B-KAPPA 40-50
FAB (HEAVY CHAIN)
IGG2B-KAPPA 40-50
FAB (LIGHT CHAIN))
6w41 CR3022 FAB HEAVY
CHAIN
CR3022 FAB LIGHT
CHAIN
(Homo
sapiens)
4 / 7
THR L  94
SER L  93
ARG H  58
TYR H  52
1.73A47.75
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.
4XE5_A_OBNA1104_2
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
6w41 CR3022 FAB LIGHT
CHAIN
(Homo
sapiens)
4 / 6
PRO L 120
ILE L 117
VAL L 150
THR L 180
1.80A10.05
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.
4XE5_A_OBNA1104_2
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
6yla LIGHT CHAIN
(Homo
sapiens)
4 / 6
VAL C 121
PHE C 145
THR C 203
ARG C 148
1.52A
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.
4XE5_A_OBNA1104_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
6yla HEAVY CHAIN
LIGHT CHAIN
(Homo
sapiens)
5 / 12
GLN C  43
GLU C  61
GLY H  26
ILE H  30
ASP C  66
1.76A11.68
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.
4XE5_A_OBNA1104_2
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
6yla LIGHT CHAIN
(Homo
sapiens)
4 / 6
PRO C 126
ILE C 123
VAL C 156
THR C 186
1.77A
None
None
MLI  C 305 ( 4.5A)
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.
4XE5_A_OBNA1104_2
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
6yla LIGHT CHAIN
(Homo
sapiens)
4 / 6
PRO L 126
ILE L 123
VAL L 156
THR L 186
1.76A
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.
1IBG_H_OBNH1_2
(IGG2B-KAPPA 40-50
FAB (HEAVY CHAIN)
IGG2B-KAPPA 40-50
FAB (LIGHT CHAIN))
6yla HEAVY CHAIN
LIGHT CHAIN
(Homo
sapiens)
4 / 7
SER L 120
SER H 190
TYR H 198
LEU H 193
1.80A
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.
4XE5_A_OBNA1104_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
6yla HEAVY CHAIN
LIGHT CHAIN
(Homo
sapiens)
5 / 12
GLN C  43
ASP C  88
GLU C  61
GLY H  26
ASP C  66
1.68A11.68
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.
1IBG_H_OBNH1_2
(IGG2B-KAPPA 40-50
FAB (HEAVY CHAIN)
IGG2B-KAPPA 40-50
FAB (LIGHT CHAIN))
6yla HEAVY CHAIN
LIGHT CHAIN
(Homo
sapiens)
4 / 7
SER C 120
SER B 190
TYR B 198
LEU B 193
1.80A
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.
4XE5_A_OBNA1104_2
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
6ym0 LIGHT CHAIN
(Homo
sapiens)
4 / 6
PRO L 126
ILE L 123
VAL L 156
THR L 186
1.75A
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.
4XE5_A_OBNA1104_2
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
6ym0 LIGHT CHAIN
(Homo
sapiens)
4 / 6
VAL L 121
PHE L 145
THR L 203
ARG L 148
1.64A
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.
1IBG_H_OBNH1_2
(IGG2B-KAPPA 40-50
FAB (HEAVY CHAIN)
IGG2B-KAPPA 40-50
FAB (LIGHT CHAIN))
6yor IGG H CHAIN
IGG L CHAIN
(Homo
sapiens)
4 / 7
SER C 120
SER B 190
TYR B 198
LEU B 193
1.79A
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.
4XE5_A_OBNA1104_2
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
6yor IGG L CHAIN
(Homo
sapiens)
4 / 6
PRO C 126
ILE C 123
VAL C 156
THR C 186
1.76A
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.
4XE5_A_OBNA1104_2
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
6yor IGG L CHAIN
(Homo
sapiens)
4 / 6
PRO L 126
ILE L 123
VAL L 156
THR L 186
1.76A
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.
1IBG_H_OBNH1_2
(IGG2B-KAPPA 40-50
FAB (HEAVY CHAIN)
IGG2B-KAPPA 40-50
FAB (LIGHT CHAIN))
6yor IGG H CHAIN
IGG L CHAIN
(Homo
sapiens)
4 / 7
SER L 120
SER H 190
TYR H 198
LEU H 193
1.80A
None