SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '5w81'

List of Similar Pattern of Amino Acids

Hit pattern: 3D amino acid arrangements similar to known drug binding site
Query pattern: Residues from known binding site for annotated drug that match the hit pattern

(Click on the DrReposER ID to view details on interfaces and similar patterns of amino acids)
(Click on the view link on the last column to view superposed patterns of amino acids)
Filter list by:
DrReposER ID / Desc. Hit
PDBID		 Hit
Macromolecule		 Res.
Matches		 Interface HETATM RMSD Dali
Z-score		 Seq.
Identity (%)		 View Dock
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1DSC_C_DVAC8_0
(ACTINOMYCIN D)		 5w81 CYSTIC FIBROSIS
TRANSMEMBRANE
CONDUCTANCE
REGULATOR
(Danio
rerio) 		3 / 3 THR A 538
THR A 500
PRO A 539
 None
 0.83A 1dscC-5w81A:
undetectable		 1dscC-5w81A:
1.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1DVX_B_DIFB125_1
(TRANSTHYRETIN)		 5w81 CYSTIC FIBROSIS
TRANSMEMBRANE
CONDUCTANCE
REGULATOR
(Danio
rerio) 		5 / 7 LEU A 601
ALA A 572
LEU A 570
SER A 488
SER A 490
 None
 0.84A 1dvxA-5w81A:
undetectable		 1dvxA-5w81A:
6.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1DVX_B_DIFB125_2
(TRANSTHYRETIN)		 5w81 CYSTIC FIBROSIS
TRANSMEMBRANE
CONDUCTANCE
REGULATOR
(Danio
rerio) 		4 / 7 LEU A 601
ALA A 572
LEU A 570
SER A 490
 None
 0.84A 1dvxB-5w81A:
undetectable		 1dvxB-5w81A:
6.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1I3W_E_DVAE8_0
(ACTINOMYCIN D)		 5w81 CYSTIC FIBROSIS
TRANSMEMBRANE
CONDUCTANCE
REGULATOR
(Danio
rerio) 		3 / 3 THR A 538
THR A 500
PRO A 539
 None
 0.87A 1i3wE-5w81A:
undetectable		 1i3wE-5w81A:
1.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1MNV_D_DVAD2_0
(ACTINOMYCIN D)		 5w81 CYSTIC FIBROSIS
TRANSMEMBRANE
CONDUCTANCE
REGULATOR
(Danio
rerio) 		3 / 3 THR A 500
PRO A 539
THR A 538
 None
 0.83A 1mnvD-5w81A:
undetectable		 1mnvD-5w81A:
1.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1OVF_B_DVAB2_0
(ACTINOMYCIN D)		 5w81 CYSTIC FIBROSIS
TRANSMEMBRANE
CONDUCTANCE
REGULATOR
(Danio
rerio) 		3 / 3 THR A 500
PRO A 539
THR A 538
 None
 0.87A 1ovfB-5w81A:
undetectable		 1ovfB-5w81A:
1.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1TT6_B_DESB128_1
(TRANSTHYRETIN)		 5w81 CYSTIC FIBROSIS
TRANSMEMBRANE
CONDUCTANCE
REGULATOR
(Danio
rerio) 		4 / 5 LEU A 601
ALA A 572
LEU A 570
SER A 490
 None
 1.13A 1tt6B-5w81A:
undetectable		 1tt6B-5w81A:
6.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1TYR_A_9CRA131_1
(TRANSTHYRETIN)		 5w81 CYSTIC FIBROSIS
TRANSMEMBRANE
CONDUCTANCE
REGULATOR
(Danio
rerio) 		4 / 6 LEU A 601
ALA A 572
LEU A 570
SER A 490
 None
 0.84A 1tyrA-5w81A:
undetectable		 1tyrA-5w81A:
6.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1TYR_B_9CRB130_1
(TRANSTHYRETIN)		 5w81 CYSTIC FIBROSIS
TRANSMEMBRANE
CONDUCTANCE
REGULATOR
(Danio
rerio) 		4 / 7 LEU A 601
ALA A 572
LEU A 570
SER A 490
 None
 0.85A 1tyrB-5w81A:
undetectable		 1tyrB-5w81A:
6.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1UNJ_R_DVAR2_0
(7-AMINO-ACTINOMYCIN
D)		 5w81 CYSTIC FIBROSIS
TRANSMEMBRANE
CONDUCTANCE
REGULATOR
(Danio
rerio) 		3 / 3 THR A 500
PRO A 539
THR A 538
 None
 0.86A 1unjR-5w81A:
undetectable		 1unjR-5w81A:
1.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1UNJ_W_DVAW8_0
(7-AMINO-ACTINOMYCIN
D)		 5w81 CYSTIC FIBROSIS
TRANSMEMBRANE
CONDUCTANCE
REGULATOR
(Danio
rerio) 		3 / 3 THR A 538
THR A 500
PRO A 539
 None
 0.85A 1unjW-5w81A:
undetectable		 1unjW-5w81A:
1.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1XOT_A_VDNA101_1
(CAMP-SPECIFIC
3',5'-CYCLIC
PHOSPHODIESTERASE 4B)		 5w81 CYSTIC FIBROSIS
TRANSMEMBRANE
CONDUCTANCE
REGULATOR
(Danio
rerio) 		5 / 12 MET A  74
LEU A 157
MET A 361
SER A 195
ILE A 153
 None
 1.39A 1xotA-5w81A:
undetectable		 1xotA-5w81A:
13.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1XOT_A_VDNA101_1
(CAMP-SPECIFIC
3',5'-CYCLIC
PHOSPHODIESTERASE 4B)		 5w81 CYSTIC FIBROSIS
TRANSMEMBRANE
CONDUCTANCE
REGULATOR
(Danio
rerio) 		5 / 12 MET A  74
LEU A 157
SER A 195
PHE A 192
ILE A 153
 None
 1.05A 1xotA-5w81A:
undetectable		 1xotA-5w81A:
13.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2FT9_A_CHDA130_0
(FATTY ACID-BINDING
PROTEIN 2, LIVER)		 5w81 CYSTIC FIBROSIS
TRANSMEMBRANE
CONDUCTANCE
REGULATOR
(Danio
rerio) 		5 / 12 PHE A1233
ILE A1211
ILE A1270
VAL A1213
LEU A1259
 None
 1.29A 2ft9A-5w81A:
undetectable		 2ft9A-5w81A:
7.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2PO5_A_CHDA501_0
(FERROCHELATASE,
MITOCHONDRIAL)		 5w81 CYSTIC FIBROSIS
TRANSMEMBRANE
CONDUCTANCE
REGULATOR
(Danio
rerio) 		5 / 12 LEU A1369
PHE A1287
SER A1253
LEU A1228
VAL A1218
 None
None
ATP  A1502 (-3.5A)
None
None
 1.03A 2po5A-5w81A:
undetectable		 2po5A-5w81A:
13.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2PO5_B_CHDB501_0
(FERROCHELATASE,
MITOCHONDRIAL)		 5w81 CYSTIC FIBROSIS
TRANSMEMBRANE
CONDUCTANCE
REGULATOR
(Danio
rerio) 		5 / 11 LEU A1369
PHE A1287
SER A1253
LEU A1228
VAL A1218
 None
None
ATP  A1502 (-3.5A)
None
None
 0.96A 2po5B-5w81A:
undetectable		 2po5B-5w81A:
13.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2VXA_A_RBFA200_1
(DODECIN)		 5w81 CYSTIC FIBROSIS
TRANSMEMBRANE
CONDUCTANCE
REGULATOR
(Danio
rerio) 		4 / 8 TYR A1100
TRP A1097
ARG A 154
HIS A 147
 None
 1.33A 2vxaA-5w81A:
undetectable
2vxaC-5w81A:
undetectable
2vxaE-5w81A:
undetectable		 2vxaA-5w81A:
4.40
2vxaC-5w81A:
4.40
2vxaE-5w81A:
4.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2VXA_C_RBFC200_1
(DODECIN)		 5w81 CYSTIC FIBROSIS
TRANSMEMBRANE
CONDUCTANCE
REGULATOR
(Danio
rerio) 		4 / 8 TYR A1100
TRP A1097
ARG A 154
HIS A 147
 None
 1.34A 2vxaB-5w81A:
undetectable
2vxaC-5w81A:
undetectable
2vxaG-5w81A:
undetectable		 2vxaB-5w81A:
4.40
2vxaC-5w81A:
4.40
2vxaG-5w81A:
4.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2VXA_D_RBFD200_1
(DODECIN)		 5w81 CYSTIC FIBROSIS
TRANSMEMBRANE
CONDUCTANCE
REGULATOR
(Danio
rerio) 		4 / 8 TYR A1100
TRP A1097
ARG A 154
HIS A 147
 None
 1.35A 2vxaD-5w81A:
undetectable
2vxaF-5w81A:
undetectable
2vxaI-5w81A:
undetectable		 2vxaD-5w81A:
4.40
2vxaF-5w81A:
4.40
2vxaI-5w81A:
4.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2VXA_G_RBFG200_1
(DODECIN)		 5w81 CYSTIC FIBROSIS
TRANSMEMBRANE
CONDUCTANCE
REGULATOR
(Danio
rerio) 		4 / 8 ARG A 154
HIS A 147
TYR A1100
TRP A1097
 None
 1.34A 2vxaF-5w81A:
undetectable
2vxaG-5w81A:
undetectable
2vxaI-5w81A:
undetectable		 2vxaF-5w81A:
4.40
2vxaG-5w81A:
4.40
2vxaI-5w81A:
4.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2VXA_H_RBFH200_1
(DODECIN)		 5w81 CYSTIC FIBROSIS
TRANSMEMBRANE
CONDUCTANCE
REGULATOR
(Danio
rerio) 		4 / 8 ARG A 154
HIS A 147
TYR A1100
TRP A1097
 None
 1.34A 2vxaB-5w81A:
undetectable
2vxaG-5w81A:
undetectable
2vxaH-5w81A:
undetectable		 2vxaB-5w81A:
4.40
2vxaG-5w81A:
4.40
2vxaH-5w81A:
4.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2VXA_I_RBFI200_1
(DODECIN)		 5w81 CYSTIC FIBROSIS
TRANSMEMBRANE
CONDUCTANCE
REGULATOR
(Danio
rerio) 		4 / 8 TYR A1100
TRP A1097
ARG A 154
HIS A 147
 None
 1.37A 2vxaH-5w81A:
undetectable
2vxaI-5w81A:
undetectable
2vxaJ-5w81A:
undetectable		 2vxaH-5w81A:
4.40
2vxaI-5w81A:
4.40
2vxaJ-5w81A:
4.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2VXA_J_RBFJ200_1
(DODECIN)		 5w81 CYSTIC FIBROSIS
TRANSMEMBRANE
CONDUCTANCE
REGULATOR
(Danio
rerio) 		4 / 8 ARG A 154
HIS A 147
TYR A1100
TRP A1097
 None
 1.36A 2vxaD-5w81A:
undetectable
2vxaJ-5w81A:
undetectable
2vxaL-5w81A:
undetectable		 2vxaD-5w81A:
4.40
2vxaJ-5w81A:
4.40
2vxaL-5w81A:
4.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2VXA_K_RBFK200_1
(DODECIN)		 5w81 CYSTIC FIBROSIS
TRANSMEMBRANE
CONDUCTANCE
REGULATOR
(Danio
rerio) 		4 / 8 ARG A 154
HIS A 147
TYR A1100
TRP A1097
 None
 1.35A 2vxaH-5w81A:
undetectable
2vxaJ-5w81A:
undetectable
2vxaK-5w81A:
undetectable		 2vxaH-5w81A:
4.40
2vxaJ-5w81A:
4.40
2vxaK-5w81A:
4.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2VXA_L_RBFL200_1
(DODECIN)		 5w81 CYSTIC FIBROSIS
TRANSMEMBRANE
CONDUCTANCE
REGULATOR
(Danio
rerio) 		4 / 8 ARG A 154
HIS A 147
TYR A1100
TRP A1097
 None
 1.34A 2vxaA-5w81A:
undetectable
2vxaK-5w81A:
undetectable
2vxaL-5w81A:
undetectable		 2vxaA-5w81A:
4.40
2vxaK-5w81A:
4.40
2vxaL-5w81A:
4.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ZBZ_A_VDXA501_1
(CYTOCHROME P450-SU1)		 5w81 CYSTIC FIBROSIS
TRANSMEMBRANE
CONDUCTANCE
REGULATOR
(Danio
rerio) 		5 / 11 THR A1424
SER A1253
LEU A1216
ILE A1268
ALA A1235
 None
ATP  A1502 (-3.5A)
None
None
None
 1.18A 2zbzA-5w81A:
undetectable		 2zbzA-5w81A:
14.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3HCO_B_CHDB1_0
(FERROCHELATASE,
MITOCHONDRIAL)		 5w81 CYSTIC FIBROSIS
TRANSMEMBRANE
CONDUCTANCE
REGULATOR
(Danio
rerio) 		4 / 4 LEU A1370
PRO A1373
LEU A1400
ARG A1240
 None
 1.20A 3hcoB-5w81A:
undetectable		 3hcoB-5w81A:
13.45
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3HEC_A_STIA1_1
(MITOGEN-ACTIVATED
PROTEIN KINASE 14)		 5w81 CYSTIC FIBROSIS
TRANSMEMBRANE
CONDUCTANCE
REGULATOR
(Danio
rerio) 		5 / 12 VAL A 455
ILE A 481
THR A 469
LEU A 467
LEU A 395
 None
 1.09A 3hecA-5w81A:
undetectable		 3hecA-5w81A:
13.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3KO0_M_TFPM202_1
(PROTEIN S100-A4)		 5w81 CYSTIC FIBROSIS
TRANSMEMBRANE
CONDUCTANCE
REGULATOR
(Danio
rerio) 		5 / 12 LEU A1347
SER A1348
ILE A1355
LEU A1325
ASP A1378
 None
ATP  A1501 ( 4.2A)
None
None
None
 1.22A 3ko0M-5w81A:
undetectable
3ko0N-5w81A:
1.1
3ko0O-5w81A:
undetectable
3ko0P-5w81A:
undetectable		 3ko0M-5w81A:
5.55
3ko0N-5w81A:
5.55
3ko0O-5w81A:
5.55
3ko0P-5w81A:
5.55
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3NXU_A_RITA600_2
(CYTOCHROME P450 3A4)		 5w81 CYSTIC FIBROSIS
TRANSMEMBRANE
CONDUCTANCE
REGULATOR
(Danio
rerio) 		4 / 7 ILE A1211
LEU A1254
THR A1424
THR A1264
 None
 1.26A 3nxuA-5w81A:
undetectable		 3nxuA-5w81A:
15.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3OZK_B_T44B128_1
(TRANSTHYRETIN)		 5w81 CYSTIC FIBROSIS
TRANSMEMBRANE
CONDUCTANCE
REGULATOR
(Danio
rerio) 		4 / 7 LEU A 601
ALA A 572
LEU A 570
SER A 490
 None
 0.93A 3ozkB-5w81A:
undetectable		 3ozkB-5w81A:
6.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3SNF_A_ACTA110_0
(PROTEIN P-30)		 5w81 CYSTIC FIBROSIS
TRANSMEMBRANE
CONDUCTANCE
REGULATOR
(Danio
rerio) 		4 / 5 ILE A 216
THR A 340
THR A 339
SER A 342
 None
 1.22A 3snfA-5w81A:
undetectable		 3snfA-5w81A:
5.17
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3THR_A_C2FA1100_1
(GLYCINE
N-METHYLTRANSFERASE)		 5w81 CYSTIC FIBROSIS
TRANSMEMBRANE
CONDUCTANCE
REGULATOR
(Danio
rerio) 		3 / 3 LEU A 146
HIS A 147
MET A 143
 None
 0.65A 3thrD-5w81A:
undetectable		 3thrD-5w81A:
11.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3W1W_A_CHDA1504_0
(FERROCHELATASE,
MITOCHONDRIAL)		 5w81 CYSTIC FIBROSIS
TRANSMEMBRANE
CONDUCTANCE
REGULATOR
(Danio
rerio) 		4 / 4 PRO A1373
LEU A1400
ILE A1398
ARG A1240
 None
 0.95A 3w1wA-5w81A:
undetectable		 3w1wA-5w81A:
13.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4D7B_A_TCWA1126_1
(TRANSTHYRETIN)		 5w81 CYSTIC FIBROSIS
TRANSMEMBRANE
CONDUCTANCE
REGULATOR
(Danio
rerio) 		4 / 6 LEU A 601
ALA A 572
LEU A 570
SER A 490
 None
 1.06A 4d7bB-5w81A:
undetectable		 4d7bB-5w81A:
6.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4D7H_A_H4BA902_1
(NITRIC OXIDE
SYNTHASE OXYGENASE)		 5w81 CYSTIC FIBROSIS
TRANSMEMBRANE
CONDUCTANCE
REGULATOR
(Danio
rerio) 		3 / 3 ARG A1056
THR A1094
TRP A1097
 None
 1.15A 4d7hA-5w81A:
1.8		 4d7hA-5w81A:
11.93
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4FGK_A_0TXA302_1
(RIBOSYLDIHYDRONICOTI
NAMIDE DEHYDROGENASE
[QUINONE])		 5w81 CYSTIC FIBROSIS
TRANSMEMBRANE
CONDUCTANCE
REGULATOR
(Danio
rerio) 		4 / 7 TRP A 402
GLY A1344
GLY A1343
GLU A1341
 ATP  A1501 (-3.3A)
None
None
None
 1.06A 4fgkB-5w81A:
undetectable		 4fgkB-5w81A:
9.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4FIA_A_0U9A601_1
(CHOLESTEROL
24-HYDROXYLASE)		 5w81 CYSTIC FIBROSIS
TRANSMEMBRANE
CONDUCTANCE
REGULATOR
(Danio
rerio) 		5 / 12 LEU A 341
VAL A 323
GLU A 932
ALA A 929
THR A 930
 None
 1.16A 4fiaA-5w81A:
0.6		 4fiaA-5w81A:
15.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4FIA_A_198A602_1
(CHOLESTEROL
24-HYDROXYLASE)		 5w81 CYSTIC FIBROSIS
TRANSMEMBRANE
CONDUCTANCE
REGULATOR
(Danio
rerio) 		5 / 12 LEU A 341
VAL A 323
GLU A 932
ALA A 929
THR A 930
 None
 1.16A 4fiaA-5w81A:
0.6		 4fiaA-5w81A:
15.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4HIV_D_DVAD2_0
(ACTINOMYCIN D)		 5w81 CYSTIC FIBROSIS
TRANSMEMBRANE
CONDUCTANCE
REGULATOR
(Danio
rerio) 		3 / 3 THR A 500
PRO A 539
THR A 538
 None
 0.86A 4hivD-5w81A:
undetectable		 4hivD-5w81A:
1.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4IKL_A_SUZA201_1
(TRANSTHYRETIN)		 5w81 CYSTIC FIBROSIS
TRANSMEMBRANE
CONDUCTANCE
REGULATOR
(Danio
rerio) 		4 / 7 LEU A 601
ALA A 572
LEU A 570
SER A 490
 None
 0.98A 4iklA-5w81A:
undetectable
4iklB-5w81A:
undetectable		 4iklA-5w81A:
6.56
4iklB-5w81A:
6.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4IKL_B_SUZB201_1
(TRANSTHYRETIN)		 5w81 CYSTIC FIBROSIS
TRANSMEMBRANE
CONDUCTANCE
REGULATOR
(Danio
rerio) 		4 / 8 LEU A 601
ALA A 572
LEU A 570
SER A 490
 None
 1.00A 4iklA-5w81A:
undetectable
4iklB-5w81A:
undetectable		 4iklA-5w81A:
6.56
4iklB-5w81A:
6.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4K0B_B_SAMB504_0
(S-ADENOSYLMETHIONINE
SYNTHASE)		 5w81 CYSTIC FIBROSIS
TRANSMEMBRANE
CONDUCTANCE
REGULATOR
(Danio
rerio) 		4 / 8 ASN A 188
ARG A 154
LEU A 157
ILE A 369
 None
 0.87A 4k0bA-5w81A:
undetectable		 4k0bA-5w81A:
14.74
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4KT0_A_PQNA2001_1
(PHOTOSYSTEM I P700
CHLOROPHYLL A
APOPROTEIN A1
PHOTOSYSTEM I
REACTION CENTER
SUBUNIT IX)		 5w81 CYSTIC FIBROSIS
TRANSMEMBRANE
CONDUCTANCE
REGULATOR
(Danio
rerio) 		5 / 11 GLY A  27
LEU A1048
GLY A1045
ILE A 155
LEU A  49
 None
 1.09A 4kt0A-5w81A:
2.0
4kt0J-5w81A:
undetectable		 4kt0A-5w81A:
19.17
4kt0J-5w81A:
3.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4L7I_B_SAMB501_0
(S-ADENOSYLMETHIONINE
SYNTHASE)		 5w81 CYSTIC FIBROSIS
TRANSMEMBRANE
CONDUCTANCE
REGULATOR
(Danio
rerio) 		4 / 8 ASN A 188
ARG A 154
LEU A 157
ILE A 369
 None
 0.95A 4l7iA-5w81A:
undetectable		 4l7iA-5w81A:
14.74
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4NC3_A_ERMA1202_1
(CHIMERA PROTEIN OF
HUMAN
5-HYDROXYTRYPTAMINE
RECEPTOR 2B AND E.
COLI SOLUBLE
CYTOCHROME B562)		 5w81 CYSTIC FIBROSIS
TRANSMEMBRANE
CONDUCTANCE
REGULATOR
(Danio
rerio) 		5 / 12 LEU A 334
ASP A 111
SER A 919
PHE A 338
LEU A 124
 None
 1.30A 4nc3A-5w81A:
2.4		 4nc3A-5w81A:
14.69
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4QYN_B_RTLB201_0
(RETINOL-BINDING
PROTEIN 2)		 5w81 CYSTIC FIBROSIS
TRANSMEMBRANE
CONDUCTANCE
REGULATOR
(Danio
rerio) 		5 / 12 ILE A 615
THR A 469
LEU A 616
LEU A 393
LEU A 447
 None
 1.35A 4qynB-5w81A:
undetectable		 4qynB-5w81A:
6.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4UG5_A_H4BA902_1
(NITRIC OXIDE
SYNTHASE OXYGENASE)		 5w81 CYSTIC FIBROSIS
TRANSMEMBRANE
CONDUCTANCE
REGULATOR
(Danio
rerio) 		3 / 3 ARG A1056
THR A1094
TRP A1097
 None
 1.25A 4ug5A-5w81A:
1.8		 4ug5A-5w81A:
11.93
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4UGL_A_H4BA902_1
(NITRIC OXIDE
SYNTHASE)		 5w81 CYSTIC FIBROSIS
TRANSMEMBRANE
CONDUCTANCE
REGULATOR
(Danio
rerio) 		3 / 3 ARG A1056
THR A1094
TRP A1097
 None
 1.16A 4uglA-5w81A:
undetectable		 4uglA-5w81A:
11.93
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4Z90_F_4LEF401_1
(GAMMA-AMINOBUTYRIC-A
CID RECEPTOR SUBUNIT
BETA-1)		 5w81 CYSTIC FIBROSIS
TRANSMEMBRANE
CONDUCTANCE
REGULATOR
(Danio
rerio) 		4 / 8 LEU A  32
THR A1096
LEU A1099
LEU A1048
 None
 0.57A 4z90F-5w81A:
4.6
4z90G-5w81A:
3.8
4z90H-5w81A:
4.6
4z90I-5w81A:
4.6
4z90J-5w81A:
4.6		 4z90F-5w81A:
13.63
4z90G-5w81A:
13.63
4z90H-5w81A:
13.63
4z90I-5w81A:
13.63
4z90J-5w81A:
13.63
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5A6I_A_TCWA1124_1
(TRANSTHYRETIN)		 5w81 CYSTIC FIBROSIS
TRANSMEMBRANE
CONDUCTANCE
REGULATOR
(Danio
rerio) 		4 / 6 LEU A 601
ALA A 572
LEU A 570
SER A 490
 None
 0.81A 5a6iA-5w81A:
undetectable		 5a6iA-5w81A:
6.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5B8I_C_FK5C201_1
(SERINE/THREONINE-PRO
TEIN PHOSPHATASE
PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE)		 5w81 CYSTIC FIBROSIS
TRANSMEMBRANE
CONDUCTANCE
REGULATOR
(Danio
rerio) 		4 / 6 LEU A 241
SER A 309
PHE A 312
GLU A 932
 None
 1.00A 5b8iA-5w81A:
undetectable		 5b8iA-5w81A:
13.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5EML_A_SAMA701_0
(PROTEIN ARGININE
N-METHYLTRANSFERASE
5)		 5w81 CYSTIC FIBROSIS
TRANSMEMBRANE
CONDUCTANCE
REGULATOR
(Danio
rerio) 		5 / 12 LEU A 260
GLY A 978
ASN A 982
ARG A 259
GLU A 268
 None
 1.38A 5emlA-5w81A:
undetectable		 5emlA-5w81A:
18.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5G6C_A_H4BA902_1
(NITRIC OXIDE
SYNTHASE OXYGENASE)		 5w81 CYSTIC FIBROSIS
TRANSMEMBRANE
CONDUCTANCE
REGULATOR
(Danio
rerio) 		3 / 3 ARG A1056
THR A1094
TRP A1097
 None
 1.18A 5g6cA-5w81A:
undetectable		 5g6cA-5w81A:
13.76
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5H8T_A_RTLA201_0
(RETINOL-BINDING
PROTEIN 1)		 5w81 CYSTIC FIBROSIS
TRANSMEMBRANE
CONDUCTANCE
REGULATOR
(Danio
rerio) 		5 / 12 LEU A1121
LEU A1030
ALA A1026
ILE A1139
SER A1017
 None
 1.17A 5h8tA-5w81A:
undetectable		 5h8tA-5w81A:
6.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5HRQ_G_IPHG101_0
(INSULIN A-CHAIN
INSULIN B-CHAIN)		 5w81 CYSTIC FIBROSIS
TRANSMEMBRANE
CONDUCTANCE
REGULATOR
(Danio
rerio) 		4 / 6 LEU A 577
CYH A 523
CYH A 589
LEU A 557
 None
 1.38A 5hrqD-5w81A:
undetectable
5hrqG-5w81A:
undetectable
5hrqH-5w81A:
undetectable		 5hrqD-5w81A:
3.62
5hrqG-5w81A:
1.71
5hrqH-5w81A:
3.62
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ICX_E_SC2E1_1
(CETUXIMAB FAB LIGHT
CHAIN
MEDITOPE)		 5w81 CYSTIC FIBROSIS
TRANSMEMBRANE
CONDUCTANCE
REGULATOR
(Danio
rerio) 		3 / 3 VAL A1009
GLN A1152
CYH A1154
 None
 0.78A 5icxA-5w81A:
undetectable
5icxE-5w81A:
undetectable		 5icxA-5w81A:
9.23
5icxE-5w81A:
1.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5IH0_A_ACTA402_0
(MACROLIDE
2'-PHOSPHOTRANSFERAS
E II)		 5w81 CYSTIC FIBROSIS
TRANSMEMBRANE
CONDUCTANCE
REGULATOR
(Danio
rerio) 		4 / 6 PHE A 158
ARG A 154
THR A1094
ILE A 155
 None
 1.24A 5ih0A-5w81A:
undetectable		 5ih0A-5w81A:
11.76
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5L4I_B_6J3B201_0
(TRANSTHYRETIN)		 5w81 CYSTIC FIBROSIS
TRANSMEMBRANE
CONDUCTANCE
REGULATOR
(Danio
rerio) 		4 / 6 LEU A 601
ALA A 572
LEU A 570
SER A 490
 None
 1.07A 5l4iB-5w81A:
undetectable		 5l4iB-5w81A:
6.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5O96_E_SAME501_0
(RIBOSOMAL RNA SMALL
SUBUNIT
METHYLTRANSFERASE E)		 5w81 CYSTIC FIBROSIS
TRANSMEMBRANE
CONDUCTANCE
REGULATOR
(Danio
rerio) 		5 / 9 LEU A 618
HIS A 619
GLY A 460
SER A 623
LEU A 440
 None
None
ATP  A1501 (-3.4A)
None
None
 1.25A 5o96E-5w81A:
undetectable
5o96F-5w81A:
undetectable		 5o96E-5w81A:
10.24
5o96F-5w81A:
10.24
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5OY0_1_PQN1842_1
(PHOTOSYSTEM I P700
CHLOROPHYLL A
APOPROTEIN A1
PHOTOSYSTEM I
REACTION CENTER
SUBUNIT IX)		 5w81 CYSTIC FIBROSIS
TRANSMEMBRANE
CONDUCTANCE
REGULATOR
(Danio
rerio) 		5 / 10 PHE A1076
ARG A 486
ALA A 565
ILE A 585
LEU A 577
 None
 1.27A 5oy01-5w81A:
1.1
5oy07-5w81A:
undetectable		 5oy01-5w81A:
4.08
5oy07-5w81A:
3.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5U4S_B_BEZB301_0
(PUTATIVE SHORT CHAIN
DEHYDROGENASE)		 5w81 CYSTIC FIBROSIS
TRANSMEMBRANE
CONDUCTANCE
REGULATOR
(Danio
rerio) 		4 / 8 ILE A 372
LEU A  70
MET A  74
LEU A  71
 None
 1.06A 5u4sB-5w81A:
undetectable		 5u4sB-5w81A:
10.74
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6NJ9_K_SAMK500_1
(HISTONE-LYSINE
N-METHYLTRANSFERASE,
H3 LYSINE-79
SPECIFIC)		 5w81 CYSTIC FIBROSIS
TRANSMEMBRANE
CONDUCTANCE
REGULATOR
(Danio
rerio) 		3 / 3 THR A 456
GLU A 582
ASN A 604
 None
 0.77A 6nj9K-5w81A:
undetectable		 6nj9K-5w81A:
14.33
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6PAH_A_DAHA600_1
(PHENYLALANINE
4-MONOOXYGENASE)		 5w81 CYSTIC FIBROSIS
TRANSMEMBRANE
CONDUCTANCE
REGULATOR
(Danio
rerio) 		4 / 6 LEU A 557
PRO A 573
HIS A 608
GLU A 582
 None
 1.07A 6pahA-5w81A:
undetectable		 6pahA-5w81A:
11.47