SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3va7'

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.
1EIZ_A_SAMA301_0
(FTSJ)		 3va7 KLLA0E08119P
(Kluyveromyces
lactis) 		5 / 12 ALA A1319
GLY A1479
GLY A1347
GLY A1348
LEU A1484
 None
None
BTI  A1901 (-3.1A)
BTI  A1901 (-4.3A)
None
 0.95A 1eizA-3va7A:
3.5		 1eizA-3va7A:
9.72
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1EJ0_A_SAMA301_0
(FTSJ)		 3va7 KLLA0E08119P
(Kluyveromyces
lactis) 		5 / 12 ALA A1319
GLY A1479
GLY A1347
GLY A1348
LEU A1484
 None
None
BTI  A1901 (-3.1A)
BTI  A1901 (-4.3A)
None
 0.94A 1ej0A-3va7A:
3.3		 1ej0A-3va7A:
9.72
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1EPB_B_9CRB165_2
(EPIDIDYMAL RETINOIC
ACID-BINDING PROTEIN)		 3va7 KLLA0E08119P
(Kluyveromyces
lactis) 		4 / 8 ALA A1592
PHE A1577
VAL A1579
VAL A1669
 None
 0.57A 1epbB-3va7A:
undetectable		 1epbB-3va7A:
9.54
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1HO5_A_ADNA1604_1
(5'-NUCLEOTIDASE)		 3va7 KLLA0E08119P
(Kluyveromyces
lactis) 		5 / 11 ARG A1610
SER A1609
GLY A1635
ASN A1330
PHE A1349
 URE  A1902 ( 4.9A)
BTI  A1901 ( 3.5A)
URE  A1902 (-3.0A)
BTI  A1901 (-3.8A)
BTI  A1901 (-4.6A)
 1.42A 1ho5A-3va7A:
undetectable		 1ho5A-3va7A:
17.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1HO5_B_ADNB2604_1
(5'-NUCLEOTIDASE)		 3va7 KLLA0E08119P
(Kluyveromyces
lactis) 		5 / 10 ARG A1610
SER A1609
GLY A1635
ASN A1330
PHE A1349
 URE  A1902 ( 4.9A)
BTI  A1901 ( 3.5A)
URE  A1902 (-3.0A)
BTI  A1901 (-3.8A)
BTI  A1901 (-4.6A)
 1.44A 1ho5B-3va7A:
undetectable		 1ho5B-3va7A:
17.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1J96_A_TESA903_1
(3ALPHA-HYDROXYSTEROI
D DEHYDROGENASE TYPE
3)		 3va7 KLLA0E08119P
(Kluyveromyces
lactis) 		4 / 6 TYR A1379
VAL A1474
ILE A1473
LEU A1418
 None
 0.92A 1j96A-3va7A:
undetectable		 1j96A-3va7A:
14.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1JG3_A_ADNA500_1
(PROTEIN-L-ISOASPARTA
TE
O-METHYLTRANSFERASE)		 3va7 KLLA0E08119P
(Kluyveromyces
lactis) 		5 / 11 GLN A1638
GLY A1619
GLY A1621
ILE A1557
GLY A1641
 None
 1.03A 1jg3A-3va7A:
3.0		 1jg3A-3va7A:
11.08
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.
1JG3_B_ADNB550_1
(PROTEIN-L-ISOASPARTA
TE
O-METHYLTRANSFERASE)		 3va7 KLLA0E08119P
(Kluyveromyces
lactis) 		5 / 11 GLN A1638
GLY A1619
GLY A1621
ILE A1557
GLY A1641
 None
 1.00A 1jg3B-3va7A:
4.0		 1jg3B-3va7A:
11.08
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.
1MRL_A_DOLA300_1
(STREPTOGRAMIN A
ACETYLTRANSFERASE)		 3va7 KLLA0E08119P
(Kluyveromyces
lactis) 		5 / 11 TYR A1209
PRO A1130
LEU A1123
ASN A 965
VAL A 967
 None
 1.28A 1mrlA-3va7A:
undetectable
1mrlB-3va7A:
undetectable		 1mrlA-3va7A:
11.14
1mrlB-3va7A:
11.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ODI_B_ADNB1237_1
(PURINE NUCLEOSIDE
PHOSPHORYLASE)		 3va7 KLLA0E08119P
(Kluyveromyces
lactis) 		5 / 11 ARG A1296
GLU A1335
SER A1317
ASN A1318
ILE A1735
 GOL  A1907 (-3.4A)
GOL  A1907 (-3.4A)
None
None
None
 1.44A 1odiB-3va7A:
undetectable		 1odiB-3va7A:
11.95
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ODI_C_ADNC1238_1
(PURINE NUCLEOSIDE
PHOSPHORYLASE)		 3va7 KLLA0E08119P
(Kluyveromyces
lactis) 		5 / 11 ARG A1296
GLU A1335
SER A1317
ASN A1318
ILE A1735
 GOL  A1907 (-3.4A)
GOL  A1907 (-3.4A)
None
None
None
 1.44A 1odiC-3va7A:
2.1		 1odiC-3va7A:
11.95
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ODI_F_ADNF1238_1
(PURINE NUCLEOSIDE
PHOSPHORYLASE)		 3va7 KLLA0E08119P
(Kluyveromyces
lactis) 		5 / 11 ARG A1296
GLU A1335
SER A1317
ASN A1318
ILE A1735
 GOL  A1907 (-3.4A)
GOL  A1907 (-3.4A)
None
None
None
 1.45A 1odiF-3va7A:
undetectable		 1odiF-3va7A:
11.95
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1P5Z_B_AR3B304_1
(DEOXYCYTIDINE KINASE)		 3va7 KLLA0E08119P
(Kluyveromyces
lactis) 		5 / 12 GLU A 923
VAL A 931
LEU A 915
TYR A 704
ARG A 987
 None
None
None
GOL  A1904 ( 4.6A)
None
 1.42A 1p5zB-3va7A:
undetectable		 1p5zB-3va7A:
12.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1PK7_C_ADNC1247_1
(PURINE NUCLEOSIDE
PHOSPHORYLASE)		 3va7 KLLA0E08119P
(Kluyveromyces
lactis) 		5 / 10 SER A1698
VAL A1695
GLU A1696
SER A1518
ASP A1667
 None
 1.43A 1pk7C-3va7A:
undetectable		 1pk7C-3va7A:
12.32
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1PK9_A_2FAA306_1
(PURINE NUCLEOSIDE
PHOSPHORYLASE)		 3va7 KLLA0E08119P
(Kluyveromyces
lactis) 		5 / 10 SER A1698
VAL A1695
GLU A1696
SER A1518
ASP A1667
 None
 1.39A 1pk9A-3va7A:
undetectable		 1pk9A-3va7A:
12.32
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1PW7_C_RABC647_1
(PURINE NUCLEOSIDE
PHOSPHORYLASE)		 3va7 KLLA0E08119P
(Kluyveromyces
lactis) 		5 / 9 SER A1698
VAL A1695
GLU A1696
SER A1518
ASP A1667
 None
 1.43A 1pw7C-3va7A:
undetectable		 1pw7C-3va7A:
12.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1Q72_H_COCH401_1
(FAB M82G2, HEAVY
CHAIN
FAB M82G2, LIGHT
CHAIN)		 3va7 KLLA0E08119P
(Kluyveromyces
lactis) 		5 / 10 VAL A1579
GLN A1478
GLY A1581
HIS A1659
PHE A1521
 None
 1.29A 1q72H-3va7A:
0.3
1q72L-3va7A:
0.0		 1q72H-3va7A:
10.67
1q72L-3va7A:
11.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1R9O_A_FLPA501_1
(CYTOCHROME P450 2C9)		 3va7 KLLA0E08119P
(Kluyveromyces
lactis) 		5 / 12 VAL A1782
ILE A1789
ASP A1786
GLY A1801
ALA A1802
 None
 1.09A 1r9oA-3va7A:
undetectable		 1r9oA-3va7A:
17.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1SDU_B_MK1B902_1
(PROTEASE RETROPEPSIN)		 3va7 KLLA0E08119P
(Kluyveromyces
lactis) 		5 / 11 LEU A1170
GLY A1187
GLY A1188
ILE A1189
ILE A1140
 None
 1.01A 1sduA-3va7A:
undetectable		 1sduA-3va7A:
6.54
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1YA3_B_STRB2001_1
(MINERALOCORTICOID
RECEPTOR)		 3va7 KLLA0E08119P
(Kluyveromyces
lactis) 		5 / 12 LEU A1222
ALA A1122
LEU A1214
LEU A1132
THR A1138
 None
 1.33A 1ya3B-3va7A:
undetectable		 1ya3B-3va7A:
12.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1Z95_A_198A501_1
(ANDROGEN RECEPTOR)		 3va7 KLLA0E08119P
(Kluyveromyces
lactis) 		5 / 12 GLN A 916
MET A 834
VAL A 895
MET A 934
ILE A 937
 GOL  A1904 (-4.5A)
None
None
GOL  A1905 (-4.1A)
None
 1.13A 1z95A-3va7A:
undetectable		 1z95A-3va7A:
11.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2BYO_A_LNLA1217_1
(LIPOPROTEIN LPPX)		 3va7 KLLA0E08119P
(Kluyveromyces
lactis) 		4 / 4 VAL A 917
LEU A1061
ILE A1045
LEU A1042
 GOL  A1904 (-3.9A)
None
None
None
 1.03A 2byoA-3va7A:
1.5		 2byoA-3va7A:
10.70
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2CBR_A_A80A201_1
(PROTEIN (CRABP-I))		 3va7 KLLA0E08119P
(Kluyveromyces
lactis) 		5 / 12 PHE A1374
VAL A1363
LEU A1360
GLY A1294
TYR A1275
 None
None
None
BTI  A1901 ( 3.9A)
None
 1.17A 2cbrA-3va7A:
undetectable		 2cbrA-3va7A:
8.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2DR2_A_TRPA479_0
(TRYPTOPHANYL-TRNA
SYNTHETASE)		 3va7 KLLA0E08119P
(Kluyveromyces
lactis) 		5 / 11 GLY A1621
GLY A1313
GLN A1638
THR A1604
CYH A1626
 None
None
None
None
URE  A1902 (-3.6A)
 1.50A 2dr2A-3va7A:
3.3		 2dr2A-3va7A:
15.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2HKK_A_ALEA300_1
(CARBONIC ANHYDRASE 2)		 3va7 KLLA0E08119P
(Kluyveromyces
lactis) 		4 / 6 ASN A1318
HIS A1315
ILE A1557
GLN A1638
 None
 1.27A 2hkkA-3va7A:
undetectable		 2hkkA-3va7A:
12.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2NO0_B_GEOB302_1
(DEOXYCYTIDINE KINASE)		 3va7 KLLA0E08119P
(Kluyveromyces
lactis) 		5 / 12 GLU A 923
VAL A 931
LEU A 915
TYR A 704
ARG A 987
 None
None
None
GOL  A1904 ( 4.6A)
None
 1.48A 2no0B-3va7A:
2.2		 2no0B-3va7A:
13.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2OAX_C_SNLC3001_1
(MINERALOCORTICOID
RECEPTOR)		 3va7 KLLA0E08119P
(Kluyveromyces
lactis) 		5 / 12 LEU A1222
ALA A1122
LEU A1214
LEU A1132
THR A1138
 None
 1.33A 2oaxC-3va7A:
undetectable		 2oaxC-3va7A:
12.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2QEU_A_ACTA141_0
(PUTATIVE
CARBOXYMUCONOLACTONE
DECARBOXYLASE)		 3va7 KLLA0E08119P
(Kluyveromyces
lactis) 		3 / 3 VAL A1554
ASP A1555
GLU A1528
 None
 0.31A 2qeuA-3va7A:
undetectable		 2qeuA-3va7A:
8.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2QEU_C_ACTC141_0
(PUTATIVE
CARBOXYMUCONOLACTONE
DECARBOXYLASE)		 3va7 KLLA0E08119P
(Kluyveromyces
lactis) 		3 / 3 VAL A1554
ASP A1555
GLU A1528
 None
 0.34A 2qeuC-3va7A:
undetectable		 2qeuC-3va7A:
8.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2QMZ_A_LDPA501_1
(RIBOSYLDIHYDRONICOTI
NAMIDE DEHYDROGENASE)		 3va7 KLLA0E08119P
(Kluyveromyces
lactis) 		4 / 7 GLY A1263
GLN A1352
PHE A1280
ILE A1276
 None
 0.84A 2qmzA-3va7A:
3.3
2qmzB-3va7A:
undetectable		 2qmzA-3va7A:
11.06
2qmzB-3va7A:
11.06
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2R5P_B_MK1B902_1
(PROTEASE)		 3va7 KLLA0E08119P
(Kluyveromyces
lactis) 		5 / 12 GLY A1187
GLY A1188
ILE A1189
VAL A1142
ILE A1140
 None
 0.76A 2r5pA-3va7A:
undetectable		 2r5pA-3va7A:
6.54
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2R5P_D_MK1D902_1
(PROTEASE)		 3va7 KLLA0E08119P
(Kluyveromyces
lactis) 		5 / 12 GLY A1187
GLY A1188
ILE A1189
VAL A1142
ILE A1140
 None
 0.76A 2r5pC-3va7A:
undetectable		 2r5pC-3va7A:
6.54
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2VE3_B_REAB1445_1
(PUTATIVE CYTOCHROME
P450 120)		 3va7 KLLA0E08119P
(Kluyveromyces
lactis) 		5 / 12 ALA A1575
THR A1643
VAL A1618
GLY A1619
PRO A1590
 None
 1.23A 2ve3B-3va7A:
undetectable		 2ve3B-3va7A:
16.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2VKE_A_TACA222_1
(TETRACYCLINE
REPRESSOR PROTEIN
CLASS D)		 3va7 KLLA0E08119P
(Kluyveromyces
lactis) 		5 / 11 ASN A1159
ARG A1180
VAL A1147
GLN A1158
SER A1106
 None
GOL  A1908 (-3.4A)
None
None
None
 1.31A 2vkeA-3va7A:
0.0		 2vkeA-3va7A:
10.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2X8O_A_OINA1314_1
(CHOLINE-BINDING
PROTEIN F)		 3va7 KLLA0E08119P
(Kluyveromyces
lactis) 		4 / 5 ASP A1103
ARG A1180
TYR A1182
GLU A1124
 None
GOL  A1908 (-3.4A)
None
None
 1.03A 2x8oA-3va7A:
undetectable		 2x8oA-3va7A:
13.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2XZ5_C_ACHC1211_0
(SOLUBLE
ACETYLCHOLINE
RECEPTOR)		 3va7 KLLA0E08119P
(Kluyveromyces
lactis) 		4 / 8 ASP A1342
SER A1099
TYR A1194
TRP A1647
 None
 1.29A 2xz5A-3va7A:
undetectable
2xz5C-3va7A:
undetectable		 2xz5A-3va7A:
12.19
2xz5C-3va7A:
12.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2Y7K_A_SALA1302_1
(LYSR-TYPE REGULATORY
PROTEIN)		 3va7 KLLA0E08119P
(Kluyveromyces
lactis) 		5 / 11 THR A1643
ILE A1627
GLY A1616
TYR A1628
GLY A1641
 None
None
None
URE  A1902 (-4.3A)
None
 0.99A 2y7kA-3va7A:
undetectable		 2y7kA-3va7A:
10.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2Y7K_A_SALA1302_1
(LYSR-TYPE REGULATORY
PROTEIN)		 3va7 KLLA0E08119P
(Kluyveromyces
lactis) 		5 / 11 THR A1643
ILE A1627
GLY A1616
TYR A1628
PRO A1590
 None
None
None
URE  A1902 (-4.3A)
None
 1.42A 2y7kA-3va7A:
undetectable		 2y7kA-3va7A:
10.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2Y7K_B_SALB1304_1
(LYSR-TYPE REGULATORY
PROTEIN)		 3va7 KLLA0E08119P
(Kluyveromyces
lactis) 		5 / 10 THR A1643
ILE A1627
GLY A1616
TYR A1628
PRO A1590
 None
None
None
URE  A1902 (-4.3A)
None
 1.36A 2y7kB-3va7A:
undetectable		 2y7kB-3va7A:
10.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2Y7K_C_SALC1302_1
(LYSR-TYPE REGULATORY
PROTEIN)		 3va7 KLLA0E08119P
(Kluyveromyces
lactis) 		5 / 12 THR A1643
ILE A1627
GLY A1616
TYR A1628
GLY A1641
 None
None
None
URE  A1902 (-4.3A)
None
 1.02A 2y7kC-3va7A:
undetectable		 2y7kC-3va7A:
10.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2Y7K_C_SALC1302_1
(LYSR-TYPE REGULATORY
PROTEIN)		 3va7 KLLA0E08119P
(Kluyveromyces
lactis) 		5 / 12 THR A1643
ILE A1627
GLY A1616
TYR A1628
PRO A1590
 None
None
None
URE  A1902 (-4.3A)
None
 1.26A 2y7kC-3va7A:
undetectable		 2y7kC-3va7A:
10.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2Y7K_D_SALD1300_1
(LYSR-TYPE REGULATORY
PROTEIN)		 3va7 KLLA0E08119P
(Kluyveromyces
lactis) 		5 / 12 THR A1643
ILE A1627
GLY A1616
TYR A1628
GLY A1641
 None
None
None
URE  A1902 (-4.3A)
None
 1.09A 2y7kD-3va7A:
undetectable		 2y7kD-3va7A:
10.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2Y7P_A_SALA1000_1
(LYSR-TYPE REGULATORY
PROTEIN)		 3va7 KLLA0E08119P
(Kluyveromyces
lactis) 		5 / 10 THR A1643
ILE A1627
GLY A1616
TYR A1628
GLY A1641
 None
None
None
URE  A1902 (-4.3A)
None
 1.04A 2y7pA-3va7A:
undetectable		 2y7pA-3va7A:
10.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2Y7W_A_SALA1300_1
(LYSR-TYPE REGULATORY
PROTEIN)		 3va7 KLLA0E08119P
(Kluyveromyces
lactis) 		5 / 9 THR A1643
ILE A1627
GLY A1616
TYR A1628
GLY A1641
 None
None
None
URE  A1902 (-4.3A)
None
 1.13A 2y7wA-3va7A:
2.0		 2y7wA-3va7A:
10.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2YS6_A_GLYA431_0
(PHOSPHORIBOSYLGLYCIN
AMIDE SYNTHETASE)		 3va7 KLLA0E08119P
(Kluyveromyces
lactis) 		4 / 8 LYS A 858
ASN A 912
ARG A 914
GLU A 918
 GOL  A1904 (-3.0A)
GOL  A1904 ( 4.3A)
GOL  A1904 ( 3.0A)
GOL  A1904 (-2.8A)
 0.90A 2ys6A-3va7A:
28.6		 2ys6A-3va7A:
18.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ARU_A_PNXA606_1
(CHITINASE A)		 3va7 KLLA0E08119P
(Kluyveromyces
lactis) 		4 / 7 PHE A1349
GLY A1635
TRP A1549
ARG A1544
 BTI  A1901 (-4.6A)
URE  A1902 (-3.0A)
None
None
 1.26A 3aruA-3va7A:
undetectable		 3aruA-3va7A:
19.32
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3CD2_A_MTXA307_1
(DIHYDROFOLATE
REDUCTASE)		 3va7 KLLA0E08119P
(Kluyveromyces
lactis) 		5 / 12 ILE A1010
GLU A 861
ILE A 860
LEU A1027
ILE A1009
 None
 1.09A 3cd2A-3va7A:
undetectable		 3cd2A-3va7A:
9.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ELZ_A_CHDA150_0
(ILEAL BILE
ACID-BINDING PROTEIN)		 3va7 KLLA0E08119P
(Kluyveromyces
lactis) 		5 / 12 PHE A1071
THR A1150
VAL A1073
LEU A1214
THR A1080
 None
 1.12A 3elzA-3va7A:
undetectable		 3elzA-3va7A:
8.09
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.
3GWX_A_EPAA1_1
(PROTEIN (PEROXISOME
PROLIFERATOR
ACTIVATED RECEPTOR
(PPAR-DELTA)))		 3va7 KLLA0E08119P
(Kluyveromyces
lactis) 		5 / 10 VAL A1375
PHE A1374
LEU A1385
VAL A1381
LEU A1404
 None
 0.92A 3gwxA-3va7A:
undetectable		 3gwxA-3va7A:
12.91
Potential target for repurposing, i.e. matched protein structure has less than 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_J_TFPJ201_1
(PROTEIN S100-A4)		 3va7 KLLA0E08119P
(Kluyveromyces
lactis) 		4 / 8 GLY A1621
CYH A1351
PHE A1331
PHE A1271
 None
 1.11A 3ko0B-3va7A:
undetectable
3ko0J-3va7A:
undetectable		 3ko0B-3va7A:
5.82
3ko0J-3va7A:
5.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3KO0_P_TFPP201_1
(PROTEIN S100-A4)		 3va7 KLLA0E08119P
(Kluyveromyces
lactis) 		4 / 7 GLY A1309
GLY A1622
PHE A1331
PHE A1271
 None
 0.97A 3ko0M-3va7A:
undetectable
3ko0P-3va7A:
undetectable		 3ko0M-3va7A:
5.82
3ko0P-3va7A:
5.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3KO0_S_TFPS201_1
(PROTEIN S100-A4)		 3va7 KLLA0E08119P
(Kluyveromyces
lactis) 		4 / 7 GLY A1621
CYH A1351
PHE A1331
PHE A1271
 None
 1.11A 3ko0K-3va7A:
undetectable
3ko0S-3va7A:
undetectable		 3ko0K-3va7A:
5.82
3ko0S-3va7A:
5.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3KO0_T_TFPT201_1
(PROTEIN S100-A4)		 3va7 KLLA0E08119P
(Kluyveromyces
lactis) 		4 / 7 GLY A1621
CYH A1351
PHE A1331
PHE A1271
 None
 1.14A 3ko0R-3va7A:
undetectable
3ko0T-3va7A:
undetectable		 3ko0R-3va7A:
5.82
3ko0T-3va7A:
5.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3LCV_B_SAMB301_0
(SISOMICIN-GENTAMICIN
RESISTANCE METHYLASE
SGM)		 3va7 KLLA0E08119P
(Kluyveromyces
lactis) 		5 / 12 ARG A1016
THR A1005
ALA A 959
LEU A1023
LEU A 961
 None
 1.31A 3lcvB-3va7A:
2.8		 3lcvB-3va7A:
14.17
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.
3LOQ_A_ACTA278_0
(UNIVERSAL STRESS
PROTEIN)		 3va7 KLLA0E08119P
(Kluyveromyces
lactis) 		3 / 3 SER A1345
GLY A1583
SER A1477
 None
 0.62A 3loqA-3va7A:
6.0		 3loqA-3va7A:
14.24
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.
3M6W_A_SAMA465_0
(RRNA METHYLASE)		 3va7 KLLA0E08119P
(Kluyveromyces
lactis) 		5 / 12 GLY A1144
GLY A1145
PRO A1130
VAL A1073
LEU A1132
 None
 0.96A 3m6wA-3va7A:
2.0		 3m6wA-3va7A:
16.90
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.
3M6W_A_SAMA465_0
(RRNA METHYLASE)		 3va7 KLLA0E08119P
(Kluyveromyces
lactis) 		5 / 12 GLY A1167
VAL A1073
PRO A1130
VAL A1082
LEU A1123
 None
 0.98A 3m6wA-3va7A:
2.0		 3m6wA-3va7A:
16.90
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.
3NXU_A_RITA600_1
(CYTOCHROME P450 3A4)		 3va7 KLLA0E08119P
(Kluyveromyces
lactis) 		5 / 12 ILE A 648
PHE A 624
ILE A 700
ALA A 630
GLY A 726
 None
None
None
None
GOL  A1905 (-3.0A)
 1.08A 3nxuA-3va7A:
undetectable		 3nxuA-3va7A:
17.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3OWX_B_XRAB233_1
(RIBOSYLDIHYDRONICOTI
NAMIDE DEHYDROGENASE
[QUINONE])		 3va7 KLLA0E08119P
(Kluyveromyces
lactis) 		5 / 11 VAL A1617
GLY A1621
GLY A1622
ASN A1318
ILE A1557
 None
 1.25A 3owxA-3va7A:
undetectable
3owxB-3va7A:
2.7		 3owxA-3va7A:
11.15
3owxB-3va7A:
11.15
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3QF1_A_PZEA6951_1
(LACTOPEROXIDASE)		 3va7 KLLA0E08119P
(Kluyveromyces
lactis) 		3 / 3 HIS A 919
ARG A 638
GLU A 634
 None
 1.15A 3qf1A-3va7A:
undetectable		 3qf1A-3va7A:
19.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3SUD_A_SUEA1201_2
(NS3 PROTEASE, NS4A
PROTEIN)		 3va7 KLLA0E08119P
(Kluyveromyces
lactis) 		4 / 4 PHE A1349
TYR A1606
ILE A1298
LEU A1297
 BTI  A1901 (-4.6A)
None
None
None
 1.45A 3sudA-3va7A:
undetectable		 3sudA-3va7A:
11.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3SUE_C_SUEC1201_2
(NS3 PROTEASE, NS4A
PROTEIN)		 3va7 KLLA0E08119P
(Kluyveromyces
lactis) 		4 / 5 PHE A1349
TYR A1606
ILE A1298
LEU A1297
 BTI  A1901 (-4.6A)
None
None
None
 1.36A 3sueC-3va7A:
undetectable		 3sueC-3va7A:
11.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3TBG_C_RTZC2_1
(CYTOCHROME P450 2D6)		 3va7 KLLA0E08119P
(Kluyveromyces
lactis) 		5 / 10 THR A1037
LEU A 977
THR A 996
LEU A 961
THR A 990
 None
 1.36A 3tbgC-3va7A:
undetectable		 3tbgC-3va7A:
16.26
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.
3UVV_A_T3A501_2
(THYROID HORMONE
RECEPTOR ALPHA)		 3va7 KLLA0E08119P
(Kluyveromyces
lactis) 		3 / 3 ARG A 873
MET A 876
ARG A 877
 None
 1.25A 3uvvA-3va7A:
undetectable		 3uvvA-3va7A:
12.15
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3VHU_A_SNLA1001_1
(MINERALOCORTICOID
RECEPTOR)		 3va7 KLLA0E08119P
(Kluyveromyces
lactis) 		5 / 12 LEU A1222
ALA A1122
LEU A1214
LEU A1132
THR A1138
 None
 1.33A 3vhuA-3va7A:
undetectable		 3vhuA-3va7A:
14.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4A97_D_ZPCD1318_2
(CYS-LOOP
LIGAND-GATED ION
CHANNEL)		 3va7 KLLA0E08119P
(Kluyveromyces
lactis) 		4 / 7 ILE A1508
GLU A1505
TYR A1445
VAL A1323
 None
 1.06A 4a97D-3va7A:
undetectable		 4a97D-3va7A:
12.54
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4A97_H_ZPCH1318_2
(CYS-LOOP
LIGAND-GATED ION
CHANNEL)		 3va7 KLLA0E08119P
(Kluyveromyces
lactis) 		4 / 7 ILE A1508
GLU A1505
TYR A1445
VAL A1323
 None
 1.11A 4a97H-3va7A:
undetectable		 4a97H-3va7A:
12.54
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4B3Q_A_NVPA999_1
(REVERSE
TRANSCRIPTASE/RIBONU
CLEASE H)		 3va7 KLLA0E08119P
(Kluyveromyces
lactis) 		4 / 7 LEU A1663
LYS A1519
VAL A1695
LEU A1523
 None
 1.06A 4b3qA-3va7A:
3.5		 4b3qA-3va7A:
19.72
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4DJF_B_C2FB300_0
(5-METHYLTETRAHYDROFO
LATE CORRINOID/IRON
SULFUR PROTEIN
METHYLTRANSFERASE)		 3va7 KLLA0E08119P
(Kluyveromyces
lactis) 		5 / 12 ASP A1584
ASP A1321
GLY A1636
SER A1609
ARG A1296
 URE  A1902 (-4.0A)
None
URE  A1902 (-3.7A)
BTI  A1901 ( 3.5A)
GOL  A1907 (-3.4A)
 1.04A 4djfB-3va7A:
undetectable		 4djfB-3va7A:
12.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4DO3_A_0LAA602_1
(FATTY-ACID AMIDE
HYDROLASE 1)		 3va7 KLLA0E08119P
(Kluyveromyces
lactis) 		4 / 5 LEU A1497
LEU A1501
MET A1476
THR A1470
 None
 1.20A 4do3A-3va7A:
undetectable		 4do3A-3va7A:
19.95
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4EAH_A_ACTA1002_0
(ACTIN, ALPHA
SKELETAL MUSCLE
FORMIN-LIKE PROTEIN
3)		 3va7 KLLA0E08119P
(Kluyveromyces
lactis) 		4 / 5 THR A1126
GLN A1083
GLU A1124
THR A1080
 GOL  A1908 (-3.7A)
None
None
None
 1.30A 4eahA-3va7A:
undetectable
4eahE-3va7A:
undetectable
4eahG-3va7A:
undetectable		 4eahA-3va7A:
17.21
4eahE-3va7A:
17.21
4eahG-3va7A:
14.95
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4EM2_A_SALA502_1
(UNCHARACTERIZED
HTH-TYPE
TRANSCRIPTIONAL
REGULATOR SAR2349)		 3va7 KLLA0E08119P
(Kluyveromyces
lactis) 		4 / 8 THR A 695
LEU A 628
VAL A 653
VAL A 671
 None
 0.99A 4em2A-3va7A:
undetectable		 4em2A-3va7A:
9.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4FGL_D_CLQD303_0
(RIBOSYLDIHYDRONICOTI
NAMIDE DEHYDROGENASE
[QUINONE])		 3va7 KLLA0E08119P
(Kluyveromyces
lactis) 		4 / 7 GLY A1263
GLN A1352
PHE A1280
ILE A1276
 None
 0.79A 4fglC-3va7A:
undetectable		 4fglC-3va7A:
11.24
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.
4FGL_D_CLQD303_1
(RIBOSYLDIHYDRONICOTI
NAMIDE DEHYDROGENASE
[QUINONE])		 3va7 KLLA0E08119P
(Kluyveromyces
lactis) 		4 / 6 GLY A1621
GLY A1622
ASN A1318
ILE A1557
 None
 0.95A 4fglD-3va7A:
undetectable		 4fglD-3va7A:
11.24
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.
4K87_A_ADNA602_1
(PROLINE--TRNA LIGASE)		 3va7 KLLA0E08119P
(Kluyveromyces
lactis) 		4 / 8 ARG A 638
GLN A 833
GLY A 893
THR A 894
 None
 0.98A 4k87A-3va7A:
4.6		 4k87A-3va7A:
19.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4KF9_A_ACTA407_0
(GLUTATHIONE
S-TRANSFERASE
PROTEIN)		 3va7 KLLA0E08119P
(Kluyveromyces
lactis) 		3 / 3 GLU A1507
ARG A1467
HIS A1468
 None
 0.86A 4kf9A-3va7A:
undetectable		 4kf9A-3va7A:
14.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4KM2_B_TOPB202_1
(DIHYDROFOLATE
REDUCTASE)		 3va7 KLLA0E08119P
(Kluyveromyces
lactis) 		5 / 12 ALA A1356
PHE A1374
VAL A1286
LEU A1297
ILE A1329
 None
 1.11A 4km2B-3va7A:
undetectable		 4km2B-3va7A:
10.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4MM7_A_29JA603_1
(TRANSPORTER)		 3va7 KLLA0E08119P
(Kluyveromyces
lactis) 		5 / 10 ASP A 989
VAL A 931
GLY A 703
ASP A 929
THR A 642
 None
 1.28A 4mm7A-3va7A:
undetectable		 4mm7A-3va7A:
17.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4MV7_A_PPFA501_1
(BIOTIN CARBOXYLASE)		 3va7 KLLA0E08119P
(Kluyveromyces
lactis) 		7 / 7 LYS A 858
ASN A 912
ARG A 914
GLN A 916
VAL A 917
GLU A 918
ARG A 960
 GOL  A1904 (-3.0A)
GOL  A1904 ( 4.3A)
GOL  A1904 ( 3.0A)
GOL  A1904 (-4.5A)
GOL  A1904 (-3.9A)
GOL  A1904 (-2.8A)
GOL  A1904 (-4.0A)
 0.65A 4mv7A-3va7A:
55.7		 4mv7A-3va7A:
20.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4NKX_B_STRB601_2
(STEROID
17-ALPHA-HYDROXYLASE
/17,20 LYASE)		 3va7 KLLA0E08119P
(Kluyveromyces
lactis) 		4 / 5 ILE A1709
LEU A1706
ASP A1451
VAL A1516
 None
 0.77A 4nkxB-3va7A:
undetectable		 4nkxB-3va7A:
18.08
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.
4OBW_A_SAMA602_1
(2-METHOXY-6-POLYPREN
YL-1,4-BENZOQUINOL
METHYLASE,
MITOCHONDRIAL)		 3va7 KLLA0E08119P
(Kluyveromyces
lactis) 		3 / 3 ASP A 849
ASN A 867
SER A 956
 None
 0.87A 4obwA-3va7A:
3.3		 4obwA-3va7A:
11.50
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.
4OK1_A_198A1001_1
(ANDROGEN RECEPTOR)		 3va7 KLLA0E08119P
(Kluyveromyces
lactis) 		5 / 12 GLN A 916
MET A 834
VAL A 895
MET A 934
ILE A 937
 GOL  A1904 (-4.5A)
None
None
GOL  A1905 (-4.1A)
None
 1.07A 4ok1A-3va7A:
undetectable		 4ok1A-3va7A:
11.24
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.
4OKT_A_198A1001_1
(ANDROGEN RECEPTOR)		 3va7 KLLA0E08119P
(Kluyveromyces
lactis) 		5 / 12 GLN A 916
MET A 834
VAL A 895
MET A 934
ILE A 937
 GOL  A1904 (-4.5A)
None
None
GOL  A1905 (-4.1A)
None
 1.09A 4oktA-3va7A:
undetectable		 4oktA-3va7A:
11.24
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.
4OKW_A_198A1001_1
(ANDROGEN RECEPTOR)		 3va7 KLLA0E08119P
(Kluyveromyces
lactis) 		5 / 12 GLN A 916
MET A 834
VAL A 895
MET A 934
ILE A 937
 GOL  A1904 (-4.5A)
None
None
GOL  A1905 (-4.1A)
None
 1.11A 4okwA-3va7A:
undetectable		 4okwA-3va7A:
11.24
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.
4P6S_A_DAHA304_1
(TYROSINASE)		 3va7 KLLA0E08119P
(Kluyveromyces
lactis) 		4 / 5 ASN A1289
HIS A1287
GLU A1792
THR A1542
 GOL  A1907 (-4.0A)
GOL  A1907 (-4.0A)
None
None
 1.45A 4p6sA-3va7A:
undetectable		 4p6sA-3va7A:
12.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4WG0_M_CHDM103_0
(NUCLEAR RECEPTOR
COACTIVATOR 2)		 3va7 KLLA0E08119P
(Kluyveromyces
lactis) 		5 / 11 LEU A1214
TYR A1209
GLU A1124
LEU A1123
LEU A1220
 None
 1.07A 4wg0K-3va7A:
undetectable
4wg0L-3va7A:
undetectable
4wg0M-3va7A:
undetectable		 4wg0K-3va7A:
3.45
4wg0L-3va7A:
3.45
4wg0M-3va7A:
3.45
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.
4ZF8_A_MYTA502_1
(BIFUNCTIONAL
P-450/NADPH-P450
REDUCTASE)		 3va7 KLLA0E08119P
(Kluyveromyces
lactis) 		4 / 6 LEU A 887
ILE A 744
ALA A 745
ALA A 879
 None
 0.74A 4zf8A-3va7A:
undetectable		 4zf8A-3va7A:
17.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ZP0_A_DXCA500_0
(MULTIDRUG
TRANSPORTER MDFA)		 3va7 KLLA0E08119P
(Kluyveromyces
lactis) 		5 / 10 TYR A1322
LEU A1448
PRO A1264
LEU A1270
GLY A1313
 None
 1.40A 4zp0A-3va7A:
undetectable		 4zp0A-3va7A:
15.40
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.
4ZVM_B_DM2B303_1
(RIBOSYLDIHYDRONICOTI
NAMIDE DEHYDROGENASE
[QUINONE])		 3va7 KLLA0E08119P
(Kluyveromyces
lactis) 		5 / 11 VAL A1617
GLY A1621
GLY A1622
ASN A1318
ILE A1557
 None
 1.27A 4zvmA-3va7A:
undetectable
4zvmB-3va7A:
undetectable		 4zvmA-3va7A:
11.06
4zvmB-3va7A:
11.06
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ZZB_E_ACTE403_0
(PROTON-GATED ION
CHANNEL)		 3va7 KLLA0E08119P
(Kluyveromyces
lactis) 		3 / 3 ARG A1292
TYR A1182
GLU A1124
 None
 0.68A 4zzbE-3va7A:
undetectable		 4zzbE-3va7A:
13.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5B6I_A_ADNA302_1
(FLUORINASE)		 3va7 KLLA0E08119P
(Kluyveromyces
lactis) 		4 / 7 THR A1611
TYR A1612
PRO A1634
THR A1613
 None
None
BTI  A1901 (-4.6A)
None
 1.26A 5b6iA-3va7A:
undetectable		 5b6iA-3va7A:
16.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5KPR_A_PAUA404_0
(PANTOTHENATE KINASE
3)		 3va7 KLLA0E08119P
(Kluyveromyces
lactis) 		4 / 5 GLU A 881
GLY A 836
SER A 885
GLY A 840
 None
 1.08A 5kprA-3va7A:
undetectable		 5kprA-3va7A:
17.48
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.
5M0O_C_EPAC502_1
(TERMINAL
OLEFIN-FORMING FATTY
ACID DECARBOXYLASE)		 3va7 KLLA0E08119P
(Kluyveromyces
lactis) 		4 / 8 LEU A 977
ALA A1007
PHE A 982
PRO A1192
 None
 0.98A 5m0oC-3va7A:
undetectable		 5m0oC-3va7A:
16.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5MVS_A_ADNA401_1
(HISTONE-LYSINE
N-METHYLTRANSFERASE,
H3 LYSINE-79
SPECIFIC)		 3va7 KLLA0E08119P
(Kluyveromyces
lactis) 		5 / 7 GLY A1603
ALA A1728
ASP A1559
PHE A1556
ASN A1318
 None
 1.42A 5mvsA-3va7A:
2.6		 5mvsA-3va7A:
15.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5VLM_D_CVID301_1
(REGULATORY PROTEIN
TETR)		 3va7 KLLA0E08119P
(Kluyveromyces
lactis) 		4 / 8 GLN A 833
GLY A 846
GLU A 881
ILE A 950
 None
 1.04A 5vlmD-3va7A:
undetectable		 5vlmD-3va7A:
9.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5X23_A_LSNA502_1
(CYTOCHROME P450 2C9)		 3va7 KLLA0E08119P
(Kluyveromyces
lactis) 		5 / 12 VAL A1669
VAL A1640
ALA A1592
LEU A1582
LEU A1663
 None
 1.35A 5x23A-3va7A:
undetectable		 5x23A-3va7A:
17.24
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.
5X80_B_SALB203_1
(UNCHARACTERIZED
HTH-TYPE
TRANSCRIPTIONAL
REGULATOR RV2887)		 3va7 KLLA0E08119P
(Kluyveromyces
lactis) 		4 / 6 PRO A1121
GLY A1188
ARG A1198
VAL A1082
 None
 0.97A 5x80A-3va7A:
undetectable
5x80B-3va7A:
undetectable		 5x80A-3va7A:
10.30
5x80B-3va7A:
10.30
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5X80_C_SALC201_1
(UNCHARACTERIZED
HTH-TYPE
TRANSCRIPTIONAL
REGULATOR RV2887)		 3va7 KLLA0E08119P
(Kluyveromyces
lactis) 		4 / 7 ARG A1198
VAL A1082
PRO A1121
GLY A1188
 None
 0.99A 5x80C-3va7A:
undetectable
5x80D-3va7A:
undetectable		 5x80C-3va7A:
10.30
5x80D-3va7A:
10.30