Ligand ID: GW6


Drugbank ID:
DB08906
(Fluticasone furoate)



Indication:
Fluticasone furoate nasal spray is indicated for the treatment of the symptoms of seasonal and perennial allergic rhinitis in patients aged 2 years and older.


Get human targets for GW6 in PDB (known and potential targets)

RESULTS FROM SUB-STRUCTURAL SIMILARITY SEARCHES MAPPED TO LIGAND 'GW6' 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.
3CLD_A_GW6A1_1
(GLUCOCORTICOID
RECEPTOR)
1uw7 NSP9
(SARS-COV
HKU-39849)
5 / 12
GLN A  11
LEU A 106
LEU A  42
THR A  67
PHE A  56
1.79A20.66
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.
3CLD_B_GW6B2_2
(GLUCOCORTICOID
RECEPTOR)
1wnc E2 GLYCOPROTEIN
(SARSr-CoV)
4 / 8
LEU A 944
ALA C 940
LEU C 941
GLN A 939
1.06A19.33
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.
3CLD_B_GW6B2_1
(GLUCOCORTICOID
RECEPTOR)
1z1j 3C-LIKE PROTEINASE
(SARSr-CoV)
5 / 12
MET B1235
GLN B1273
ARG B1222
LEU B1205
THR B1198
1.79A21.79
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.
3CLD_A_GW6A1_1
(GLUCOCORTICOID
RECEPTOR)
1z1j 3C-LIKE PROTEINASE
(SARSr-CoV)
5 / 12
GLY B1179
LEU B1087
CYH B1044
LEU B1027
PHE B1181
1.77A21.79
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.
3CLD_B_GW6B2_2
(GLUCOCORTICOID
RECEPTOR)
2ahm REPLICASE
POLYPROTEIN 1AB,
HEAVY CHAIN
REPLICASE
POLYPROTEIN 1AB,
LIGHT CHAIN
(SARSr-CoV)
4 / 8
ALA G  68
LEU D  33
MET G  72
ILE H 111
1.10A21.25
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.
3CLD_B_GW6B2_2
(GLUCOCORTICOID
RECEPTOR)
2ahm REPLICASE
POLYPROTEIN 1AB,
HEAVY CHAIN
REPLICASE
POLYPROTEIN 1AB,
LIGHT CHAIN
(SARSr-CoV)
4 / 8
LEU A  18
MET E  99
LEU E 100
GLN A  68
1.01A16.94
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.
3CLD_B_GW6B2_2
(GLUCOCORTICOID
RECEPTOR)
2ajf ACE2
(Homo
sapiens)
4 / 8
LEU B 100
ALA B  25
LEU B  29
GLN B  98
1.27A17.24
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.
3CLD_A_GW6A1_1
(GLUCOCORTICOID
RECEPTOR)
2amd 3C-LIKE PROTEINASE
(SARSr-CoV)
5 / 12
GLY A 179
LEU A  87
CYH A  44
LEU A  27
PHE A 181
1.71A19.05
None
None
None
9IN  A1001 ( 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.
3CLD_B_GW6B2_2
(GLUCOCORTICOID
RECEPTOR)
2beq SPIKE GLYCOPROTEIN
(SARSr-CoV)
4 / 8
LEU B 944
ALA A 940
LEU A 941
GLN B 939
1.20A7.42
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3CLD_A_GW6A1_1
(GLUCOCORTICOID
RECEPTOR)
2fe8 REPLICASE
POLYPROTEIN 1AB
(SARSr-CoV)
5 / 12
ASN B 110
GLY B 161
GLN C 175
LEU C 174
THR C 199
1.77A22.64
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.
3CLD_A_GW6A1_1
(GLUCOCORTICOID
RECEPTOR)
2gt8 3C-LIKE PROTEINASE
(SARSr-CoV)
5 / 12
GLY A 179
LEU A  87
CYH A  44
LEU A  27
PHE A 181
1.65A20.74
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.
3CLD_B_GW6B2_2
(GLUCOCORTICOID
RECEPTOR)
2qcy 3C-LIKE PROTEINASE
(SARSr-CoV)
4 / 8
LEU A  30
ALA A 116
LEU A 115
GLN A  19
1.19A21.47
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.
3CLD_A_GW6A1_1
(GLUCOCORTICOID
RECEPTOR)
2vj1 MAIN PROTEINASE
(SARSr-CoV)
5 / 12
ASN B  84
LEU B  58
CYH B  44
LEU B  87
THR B 175
1.77A20.94
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.
3CLD_B_GW6B2_2
(GLUCOCORTICOID
RECEPTOR)
2wct NSP3
(SARSr-CoV)
4 / 8
LEU B 407
MET D 536
LEU D 537
ILE B 484
1.20A21.07
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.
3CLD_A_GW6A1_1
(GLUCOCORTICOID
RECEPTOR)
2xyq PUTATIVE 2'-O-METHYL
TRANSFERASE
(SARSr-CoV)
5 / 12
ASN A  29
GLY A  31
MET A  42
LEU A 239
THR A 172
1.77A24.83
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.
3CLD_A_GW6A1_1
(GLUCOCORTICOID
RECEPTOR)
2xyr PUTATIVE 2'-O-METHYL
TRANSFERASE
(SARSr-CoV)
5 / 12
ASN A  29
GLY A  31
MET A  42
LEU A 239
THR A 172
1.74A23.81
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.
3CLD_B_GW6B2_2
(GLUCOCORTICOID
RECEPTOR)
3e9s NSP3
(SARSr-CoV)
5 / 8
LEU A 186
ALA A 205
LEU A 200
TYR A 311
ILE A 315
1.74A22.80
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.
3CLD_A_GW6A1_1
(GLUCOCORTICOID
RECEPTOR)
3eaj 3C-LIKE PROTEINASE
(SARSr-CoV)
5 / 12
GLY B 179
LEU B  87
CYH B  44
LEU B  27
PHE B 181
1.74A20.13
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3CLD_B_GW6B2_2
(GLUCOCORTICOID
RECEPTOR)
3ebn REPLICASE
POLYPROTEIN 1AB
(SARSr-CoV)
4 / 8
LEU C 287
ALA A 206
LEU A 208
ILE B 286
1.11A19.09
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3CLD_B_GW6B2_1
(GLUCOCORTICOID
RECEPTOR)
3f9e 3C-LIKE PROTEINASE
(SARSr-CoV)
5 / 12
ARG A 131
MET A 235
LEU A 268
CYH A 265
THR A 225
1.70A20.06
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.
3CLD_A_GW6A1_1
(GLUCOCORTICOID
RECEPTOR)
3f9f 3C-LIKE PROTEINASE
(SARSr-CoV)
5 / 12
ASN A 214
GLY A   2
GLN A 299
ARG A 298
LEU A 253
1.77A21.30
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.
3CLD_B_GW6B2_1
(GLUCOCORTICOID
RECEPTOR)
3i6l BETA-2-MICROGLOBULIN
(Homo
sapiens)
5 / 12
ASN E  42
GLY E  43
ARG E  45
LEU E  23
THR E  73
1.79A16.54
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.
3CLD_B_GW6B2_2
(GLUCOCORTICOID
RECEPTOR)
3i6l HLA, A-24
NUCLEOPROTEIN
PEPTIDE
(Homo
sapiens;
SARSr-CoV)
4 / 8
ALA D  81
LEU F   9
GLN D  96
ILE D  23
1.22A19.93
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.
3CLD_B_GW6B2_1
(GLUCOCORTICOID
RECEPTOR)
3iwm 3C-LIKE PROTEINASE
(SARSr-CoV)
5 / 12
GLY B 179
GLN B  83
ARG B  88
MET B  17
CYH B 160
1.74A21.47
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.
3CLD_A_GW6A1_1
(GLUCOCORTICOID
RECEPTOR)
3iwm 3C-LIKE PROTEINASE
(SARSr-CoV)
5 / 12
GLY A 179
LEU A  87
CYH A  44
LEU A  27
PHE A 181
1.61A21.47
None
None
None
PJE  H   5 (-4.4A)
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3CLD_B_GW6B2_2
(GLUCOCORTICOID
RECEPTOR)
3iwm 3C-LIKE PROTEINASE
(SARSr-CoV)
5 / 8
LEU B 271
MET B 264
ALA B 266
LEU D 220
TYR B 237
1.76A21.47
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.
3CLD_B_GW6B2_2
(GLUCOCORTICOID
RECEPTOR)
3m3t 3C-LIKE PROTEINASE
(SARSr-CoV)
4 / 8
LEU A  30
ALA A 116
LEU A 115
GLN A  19
1.26A20.99
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.
3CLD_B_GW6B2_2
(GLUCOCORTICOID
RECEPTOR)
3scl ACE2
(Paguma
larvata;
Homo
sapiens;
SARSr-CoV)
5 / 8
LEU A 267
ALA A 153
MET A 152
TYR A 158
ILE A 256
1.67A16.64
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.
3CLD_A_GW6A1_1
(GLUCOCORTICOID
RECEPTOR)
4mds 3C-LIKE PROTEINASE
(SARSr-CoV)
5 / 12
GLY A 179
LEU A  87
CYH A  44
LEU A  27
PHE A 181
1.78A20.52
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.
3CLD_A_GW6A1_1
(GLUCOCORTICOID
RECEPTOR)
4mm3 PAPAIN-LIKE
PROTEINASE
UBIQUITIN
(Homo
sapiens;
SARSr-CoV)
5 / 12
GLY A  47
GLN B 233
MET B 245
LEU B 235
THR B 171
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.
3CLD_B_GW6B2_2
(GLUCOCORTICOID
RECEPTOR)
4rna PAPAIN-LIKE PROTEASE
(Human
betacoronavirus
2c
EMC/2012)
4 / 8
LEU A 311
ALA A 166
LEU A 170
GLN A 213
1.27A24.48
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.
3CLD_A_GW6A1_1
(GLUCOCORTICOID
RECEPTOR)
5c5n 3C-LIKE PROTEINASE
(SARSr-CoV)
5 / 12
GLY A 179
LEU A  87
CYH A  44
LEU A  27
PHE A 181
1.67A21.47
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.
3CLD_A_GW6A1_2
(GLUCOCORTICOID
RECEPTOR)
5nfy POLYPROTEIN 1AB
(SARS-COV
Frankfurt
1)
5 / 9
LEU B 170
LEU B 174
ALA B 214
MET B 195
TYR B 235
1.77A19.20
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3CLD_A_GW6A1_1
(GLUCOCORTICOID
RECEPTOR)
5x58 SPIKE GLYCOPROTEIN
(SARS-COV
BJ01)
5 / 12
GLY C 780
GLN C 902
LEU C 898
LEU C1031
THR C 863
1.79A12.77
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.
3CLD_B_GW6B2_2
(GLUCOCORTICOID
RECEPTOR)
5x5b SPIKE GLYCOPROTEIN
(SARS-COV
BJ01)
4 / 8
LEU C 986
ALA C 748
LEU C 749
ILE C 979
1.20A12.77
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.
3CLD_B_GW6B2_2
(GLUCOCORTICOID
RECEPTOR)
5x5f S PROTEIN
(MERS-CoV)
4 / 8
LEU B 873
ALA B1130
LEU B 894
ILE B 955
1.19A11.68
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.
3CLD_A_GW6A1_1
(GLUCOCORTICOID
RECEPTOR)
5xlr SPIKE GLYCOPROTEIN
(SARSr-CoV)
5 / 12
ASN B 304
GLY B 580
GLN B 301
LEU A 749
LEU A 840
1.62A11.91
ASN  B 304 ( 0.6A)
GLY  B 580 ( 0.0A)
GLN  B 301 ( 0.6A)
LEU  A 749 ( 0.6A)
LEU  A 840 ( 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.
3CLD_B_GW6B2_2
(GLUCOCORTICOID
RECEPTOR)
5zvm SPIKE GLYCOPROTEIN
(SARSr-CoV)
4 / 8
LEU A 944
ALA B 940
LEU B 941
GLN A 939
1.15A20.99
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.
3CLD_A_GW6A1_1
(GLUCOCORTICOID
RECEPTOR)
6acg SPIKE GLYCOPROTEIN
(SARSr-CoV)
5 / 12
GLY A 780
GLN A 902
LEU A 898
LEU A1031
THR A 863
1.55A11.91
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.
3CLD_B_GW6B2_2
(GLUCOCORTICOID
RECEPTOR)
6acg SPIKE GLYCOPROTEIN
(SARSr-CoV)
4 / 8
LEU A 930
ALA A 926
LEU A 927
ILE A1000
0.95A11.91
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.
3CLD_A_GW6A1_2
(GLUCOCORTICOID
RECEPTOR)
6acj SPIKE GLYCOPROTEIN
(SARSr-CoV)
5 / 9
LEU C 286
LEU C 283
TRP C 619
ALA C 595
GLN C 301
1.65A11.91
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.
3CLD_A_GW6A1_1
(GLUCOCORTICOID
RECEPTOR)
6crv SPIKE
GLYCOPROTEIN,FIBRITI
N
(SARSr-CoV)
5 / 12
ASN C 304
GLY C 579
LEU A 843
LEU A 749
THR A 743
1.59A12.64
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.
3CLD_B_GW6B2_2
(GLUCOCORTICOID
RECEPTOR)
6crw SPIKE
GLYCOPROTEIN,FIBRITI
N
(SARSr-CoV)
4 / 8
LEU A 499
LEU A 377
TYR A 367
ILE A 397
1.16A12.69
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.
3CLD_A_GW6A1_1
(GLUCOCORTICOID
RECEPTOR)
6crx SPIKE
GLYCOPROTEIN,FIBRITI
N
(SARSr-CoV)
5 / 12
ASN C 304
GLY C 579
LEU A 843
LEU A 749
THR A 743
1.53A12.69
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.
3CLD_B_GW6B2_2
(GLUCOCORTICOID
RECEPTOR)
6jyt HELICASE
(SARSr-CoV)
5 / 8
LEU A 295
LEU A 280
GLN A 270
MET A 436
ILE A 258
1.64A17.98
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.
3CLD_B_GW6B2_2
(GLUCOCORTICOID
RECEPTOR)
6m18 SODIUM-DEPENDENT
NEUTRAL AMINO ACID
TRANSPORTER B(0)AT1
(Homo
sapiens)
4 / 8
LEU C 127
ALA C 489
LEU C 485
ILE C 462
1.19A18.88
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.
3CLD_B_GW6B2_2
(GLUCOCORTICOID
RECEPTOR)
6m18 ACE2
(Homo
sapiens)
4 / 8
LEU B 100
ALA B  25
LEU B  29
GLN B  98
1.22A15.25
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.
3CLD_A_GW6A1_1
(GLUCOCORTICOID
RECEPTOR)
6m1d SODIUM-DEPENDENT
NEUTRAL AMINO ACID
TRANSPORTER B(0)AT1
(Homo
sapiens)
5 / 12
GLN C 444
ARG C 447
LEU C 461
CYH C 463
THR C 466
1.75A18.88
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.
3CLD_B_GW6B2_2
(GLUCOCORTICOID
RECEPTOR)
6nb6 SPIKE GLYCOPROTEIN
(SARSr-CoV)
4 / 8
LEU B 597
ALA B 654
GLN B 630
ILE B 637
1.15A11.72
None
None
NAG  B1323 (-3.5A)
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.
3CLD_A_GW6A1_1
(GLUCOCORTICOID
RECEPTOR)
6nb6 SPIKE GLYCOPROTEIN
(SARSr-CoV)
5 / 12
GLY A 780
GLN A 902
LEU A 898
LEU A1031
THR A 863
1.68A11.72
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3CLD_A_GW6A1_1
(GLUCOCORTICOID
RECEPTOR)
6nur NSP7
NSP8
(SARSr-CoV)
5 / 12
GLY C  64
GLN C  63
LEU C  60
LEU C  17
THR D  84
1.57A16.53
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.
3CLD_B_GW6B2_2
(GLUCOCORTICOID
RECEPTOR)
6nur NSP7
NSP8
(SARSr-CoV)
5 / 8
LEU C  55
ALA C  42
LEU C  40
GLN C  34
ILE D 119
1.73A16.53
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.
3CLD_B_GW6B2_2
(GLUCOCORTICOID
RECEPTOR)
6w41 CR3022 FAB LIGHT
CHAIN
(Homo
sapiens)
4 / 8
LEU L 136
ALA L 112
LEU L 201
TYR L 173
1.77A22.05
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3CLD_B_GW6B2_2
(GLUCOCORTICOID
RECEPTOR)
6w41 CR3022 FAB HEAVY
CHAIN
(Homo
sapiens)
4 / 8
LEU H  80
LEU H  18
GLN H   6
ILE H  34
1.62A21.60
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.
3CLD_B_GW6B2_2
(GLUCOCORTICOID
RECEPTOR)
6w41 CR3022 FAB HEAVY
CHAIN
CR3022 FAB LIGHT
CHAIN
(Homo
sapiens)
4 / 8
LEU H  45
MET H 100
GLN L  37
TYR L  86
1.66A21.60
None
None
SO4  L 302 ( 4.8A)
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3CLD_B_GW6B2_2
(GLUCOCORTICOID
RECEPTOR)
6w41 CR3022 FAB HEAVY
CHAIN
CR3022 FAB LIGHT
CHAIN
(Homo
sapiens)
4 / 8
ALA L  51
GLN L  89
TYR L  96
ILE H  98
1.73A22.05
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.
3CLD_B_GW6B2_2
(GLUCOCORTICOID
RECEPTOR)
6yla HEAVY CHAIN
LIGHT CHAIN
(Homo
sapiens)
4 / 8
LEU H  45
MET H 106
GLN L  43
TYR L  92
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.
3CLD_B_GW6B2_2
(GLUCOCORTICOID
RECEPTOR)
6yla HEAVY CHAIN
(Homo
sapiens)
4 / 8
LEU B  81
LEU B  18
GLN B   6
ILE B  34
1.55A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3CLD_B_GW6B2_2
(GLUCOCORTICOID
RECEPTOR)
6yor IGG H CHAIN
IGG L CHAIN
(Homo
sapiens)
4 / 8
LEU H  45
MET H 106
GLN L  43
TYR L  92
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.
3CLD_B_GW6B2_2
(GLUCOCORTICOID
RECEPTOR)
6yor IGG H CHAIN
IGG L CHAIN
(Homo
sapiens)
4 / 8
LEU B  45
MET B 106
GLN C  43
TYR C  92
1.51A
None