SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '4xai'

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.
1C4D_B_DVAB8_0
(GRAMICIDIN A)		 4xai MALTOSE-BINDING
PERIPLASMIC
PROTEIN,TAILLESS
ORTHOLOG
(Escherichia
coli;
Tribolium
castaneum) 		3 / 3 TRP A 160
VAL A 261
TRP A 342
 None
None
MAL  A1401 (-3.7A)
 1.29A 1c4dA-4xaiA:
undetectable
1c4dB-4xaiA:
undetectable		 1c4dA-4xaiA:
3.05
1c4dB-4xaiA:
3.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1E06_A_IPBA600_0
(ODORANT-BINDING
PROTEIN)		 4xai MALTOSE-BINDING
PERIPLASMIC
PROTEIN,TAILLESS
ORTHOLOG
(Escherichia
coli;
Tribolium
castaneum) 		4 / 6 VAL A  10
VAL A  52
ILE A  62
ASN A 269
 None
 0.99A 1e06A-4xaiA:
undetectable		 1e06A-4xaiA:
13.79
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.
1FBY_A_9CRA500_1
(RETINOIC ACID
RECEPTOR RXR-ALPHA)		 4xai GRUNGE, ISOFORM J
MALTOSE-BINDING
PERIPLASMIC
PROTEIN,TAILLESS
ORTHOLOG
(Drosophila
melanogaster;
Escherichia
coli;
Tribolium
castaneum) 		5 / 12 ALA A1204
ALA A1203
GLN A1205
LEU P1820
ALA P1819
 None
 0.89A 1fbyA-4xaiA:
14.5		 1fbyA-4xaiA:
19.04
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.
1FBY_B_9CRB1500_1
(RETINOIC ACID
RECEPTOR RXR-ALPHA)		 4xai GRUNGE, ISOFORM J
MALTOSE-BINDING
PERIPLASMIC
PROTEIN,TAILLESS
ORTHOLOG
(Drosophila
melanogaster;
Escherichia
coli;
Tribolium
castaneum) 		5 / 12 ALA A1204
ALA A1203
GLN A1205
LEU P1820
ALA P1819
 None
 0.87A 1fbyB-4xaiA:
15.5		 1fbyB-4xaiA:
19.04
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.
1JKH_A_EFZA999_1
(HIV-1 RT, A-CHAIN
HIV-1 RT, B-CHAIN)		 4xai MALTOSE-BINDING
PERIPLASMIC
PROTEIN,TAILLESS
ORTHOLOG
(Escherichia
coli;
Tribolium
castaneum) 		5 / 11 LEU A 282
VAL A  25
VAL A  37
GLY A  26
LEU A 287
 None
 1.42A 1jkhA-4xaiA:
undetectable
1jkhB-4xaiA:
undetectable		 1jkhA-4xaiA:
22.27
1jkhB-4xaiA:
21.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1LIN_A_TFPA154_1
(CALMODULIN)		 4xai MALTOSE-BINDING
PERIPLASMIC
PROTEIN,TAILLESS
ORTHOLOG
(Escherichia
coli;
Tribolium
castaneum) 		4 / 7 GLU A 133
LEU A 137
MET A 226
LEU A 117
 None
 1.12A 1linA-4xaiA:
undetectable		 1linA-4xaiA:
14.45
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.
1NHZ_A_486A800_1
(GLUCOCORTICOID
RECEPTOR)		 4xai MALTOSE-BINDING
PERIPLASMIC
PROTEIN,TAILLESS
ORTHOLOG
(Escherichia
coli;
Tribolium
castaneum) 		5 / 12 LEU A 162
VAL A 359
LEU A 200
MET A 206
LEU A 153
 None
 1.41A 1nhzA-4xaiA:
12.3		 1nhzA-4xaiA:
21.36
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.
1QU2_A_MRCA1993_2
(ISOLEUCYL-TRNA
SYNTHETASE)		 4xai MALTOSE-BINDING
PERIPLASMIC
PROTEIN,TAILLESS
ORTHOLOG
(Escherichia
coli;
Tribolium
castaneum) 		3 / 3 GLU A 113
TRP A 232
LYS A 275
 MAL  A1401 (-3.0A)
MAL  A1401 (-4.3A)
None
 1.37A 1qu2A-4xaiA:
2.2		 1qu2A-4xaiA:
19.47
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.
1XZ1_A_HLTA2001_1
(FERRITIN LIGHT CHAIN)		 4xai MALTOSE-BINDING
PERIPLASMIC
PROTEIN,TAILLESS
ORTHOLOG
(Escherichia
coli;
Tribolium
castaneum) 		4 / 4 LEU A 306
SER A 308
TYR A 309
LEU A 292
 None
 1.31A 1xz1A-4xaiA:
undetectable		 1xz1A-4xaiA:
15.82
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.
1XZ3_A_ICFA201_1
(FERRITIN LIGHT CHAIN)		 4xai MALTOSE-BINDING
PERIPLASMIC
PROTEIN,TAILLESS
ORTHOLOG
(Escherichia
coli;
Tribolium
castaneum) 		4 / 4 LEU A 306
SER A 308
TYR A 309
LEU A 292
 None
 1.31A 1xz3A-4xaiA:
undetectable		 1xz3A-4xaiA:
15.82
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.
2ACL_A_REAA502_1
(RETINOIC ACID
RECEPTOR RXR-ALPHA)		 4xai GRUNGE, ISOFORM J
MALTOSE-BINDING
PERIPLASMIC
PROTEIN,TAILLESS
ORTHOLOG
(Drosophila
melanogaster;
Escherichia
coli;
Tribolium
castaneum) 		5 / 12 ALA A1204
ALA A1203
GLN A1205
LEU P1820
ALA P1819
 None
 0.98A 2aclA-4xaiA:
14.3
2aclE-4xaiA:
14.5		 2aclA-4xaiA:
18.87
2aclE-4xaiA:
18.87
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.
2ACL_G_REAG501_1
(RETINOIC ACID
RECEPTOR RXR-ALPHA)		 4xai GRUNGE, ISOFORM J
MALTOSE-BINDING
PERIPLASMIC
PROTEIN,TAILLESS
ORTHOLOG
(Drosophila
melanogaster;
Escherichia
coli;
Tribolium
castaneum) 		5 / 12 ALA A1204
ALA A1203
GLN A1205
LEU P1820
ALA P1819
 None
 0.97A 2aclG-4xaiA:
14.0		 2aclG-4xaiA:
18.87
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.
2H42_A_VIAA901_1
(CGMP-SPECIFIC
3',5'-CYCLIC
PHOSPHODIESTERASE)		 4xai MALTOSE-BINDING
PERIPLASMIC
PROTEIN,TAILLESS
ORTHOLOG
(Escherichia
coli;
Tribolium
castaneum) 		5 / 11 ALA A 305
ILE A 110
VAL A  99
LEU A  78
ILE A  81
 None
 1.24A 2h42A-4xaiA:
undetectable		 2h42A-4xaiA:
21.61
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.
2JFA_B_CCSB417_0
(ESTROGEN RECEPTOR)		 4xai MALTOSE-BINDING
PERIPLASMIC
PROTEIN,TAILLESS
ORTHOLOG
(Escherichia
coli;
Tribolium
castaneum) 		3 / 3 GLN A 337
LYS A 181
VAL A 183
 None
 0.86A 2jfaB-4xaiA:
12.0		 2jfaB-4xaiA:
17.30
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.
2OIP_B_MTXB609_1
(CHAIN A, CRYSTAL
STRUCTURE OF DHFR)		 4xai MALTOSE-BINDING
PERIPLASMIC
PROTEIN,TAILLESS
ORTHOLOG
(Escherichia
coli;
Tribolium
castaneum) 		5 / 12 ASP A1271
LEU A1274
LYS A1275
PHE A1273
LEU A1377
 None
 1.24A 2oipB-4xaiA:
undetectable		 2oipB-4xaiA:
20.94
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.
2VE3_A_REAA1445_1
(PUTATIVE CYTOCHROME
P450 120)		 4xai MALTOSE-BINDING
PERIPLASMIC
PROTEIN,TAILLESS
ORTHOLOG
(Escherichia
coli;
Tribolium
castaneum) 		5 / 12 ALA A 266
LEU A 282
PHE A 281
VAL A 295
GLY A  18
 None
 1.08A 2ve3A-4xaiA:
2.2		 2ve3A-4xaiA:
22.50
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.
3B9M_A_SALA1100_1
(SERUM ALBUMIN)		 4xai MALTOSE-BINDING
PERIPLASMIC
PROTEIN,TAILLESS
ORTHOLOG
(Escherichia
coli;
Tribolium
castaneum) 		4 / 4 LEU A1242
ARG A1339
LEU A1340
ALA A1302
 None
 1.14A 3b9mA-4xaiA:
3.2		 3b9mA-4xaiA:
23.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3BGD_A_PM6A301_1
(THIOPURINE
S-METHYLTRANSFERASE)		 4xai MALTOSE-BINDING
PERIPLASMIC
PROTEIN,TAILLESS
ORTHOLOG
(Escherichia
coli;
Tribolium
castaneum) 		4 / 6 PHE A 260
ALA A 164
LEU A 249
PRO A 161
 None
 0.97A 3bgdA-4xaiA:
undetectable		 3bgdA-4xaiA:
19.61
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.
3BJW_C_SVRC507_1
(PHOSPHOLIPASE A2)		 4xai MALTOSE-BINDING
PERIPLASMIC
PROTEIN,TAILLESS
ORTHOLOG
(Escherichia
coli;
Tribolium
castaneum) 		4 / 7 VAL A 112
GLY A 302
PRO A 231
LYS A 307
 None
 0.68A 3bjwC-4xaiA:
undetectable		 3bjwC-4xaiA:
11.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3FC6_A_REAA501_1
(RETINOIC ACID
RECEPTOR RXR-ALPHA)		 4xai GRUNGE, ISOFORM J
MALTOSE-BINDING
PERIPLASMIC
PROTEIN,TAILLESS
ORTHOLOG
(Drosophila
melanogaster;
Escherichia
coli;
Tribolium
castaneum) 		5 / 11 ALA A1204
ALA A1203
GLN A1205
LEU P1820
ALA P1819
 None
 0.98A 3fc6A-4xaiA:
14.9		 3fc6A-4xaiA:
19.38
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.
3FC6_C_REAC501_1
(RETINOIC ACID
RECEPTOR RXR-ALPHA)		 4xai GRUNGE, ISOFORM J
MALTOSE-BINDING
PERIPLASMIC
PROTEIN,TAILLESS
ORTHOLOG
(Drosophila
melanogaster;
Escherichia
coli;
Tribolium
castaneum) 		5 / 12 ALA A1204
ALA A1203
GLN A1205
LEU P1820
ALA P1819
 None
 0.95A 3fc6C-4xaiA:
14.8		 3fc6C-4xaiA:
19.38
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.
3H0A_A_9RAA500_1
(RETINOIC ACID
RECEPTOR RXR-ALPHA)		 4xai GRUNGE, ISOFORM J
MALTOSE-BINDING
PERIPLASMIC
PROTEIN,TAILLESS
ORTHOLOG
(Drosophila
melanogaster;
Escherichia
coli;
Tribolium
castaneum) 		5 / 12 ALA A1204
LEU P1823
ALA P1819
CYH A1260
LEU A1256
 None
 0.97A 3h0aA-4xaiA:
14.1		 3h0aA-4xaiA:
18.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3HZN_G_ACTG225_0
(OXYGEN-INSENSITIVE
NAD(P)H
NITROREDUCTASE)		 4xai MALTOSE-BINDING
PERIPLASMIC
PROTEIN,TAILLESS
ORTHOLOG
(Escherichia
coli;
Tribolium
castaneum) 		3 / 3 PRO A1224
LEU A1225
GLN A1228
 None
 0.73A 3hznG-4xaiA:
undetectable
3hznH-4xaiA:
undetectable		 3hznG-4xaiA:
20.00
3hznH-4xaiA:
20.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3JYR_A_ACRA371_1
(MALTOSE-BINDING
PERIPLASMIC PROTEIN)		 4xai MALTOSE-BINDING
PERIPLASMIC
PROTEIN,TAILLESS
ORTHOLOG
(Escherichia
coli;
Tribolium
castaneum) 		9 / 12 ASP A  16
LYS A  17
LYS A  44
GLU A  46
GLU A  47
ALA A  65
ASP A  67
ARG A  68
TRP A 232
 MAL  A1401 (-3.2A)
MAL  A1401 (-2.6A)
None
None
None
MAL  A1401 (-3.4A)
MAL  A1401 (-2.7A)
MAL  A1401 (-4.3A)
MAL  A1401 (-4.3A)
 0.75A 3jyrA-4xaiA:
62.1		 3jyrA-4xaiA:
77.21
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3JYR_A_ACRA371_1
(MALTOSE-BINDING
PERIPLASMIC PROTEIN)		 4xai MALTOSE-BINDING
PERIPLASMIC
PROTEIN,TAILLESS
ORTHOLOG
(Escherichia
coli;
Tribolium
castaneum) 		10 / 12 ASP A  16
LYS A  17
LYS A  44
GLU A  46
GLU A  47
ALA A  65
ASP A  67
GLU A 113
PRO A 156
TRP A 232
 MAL  A1401 (-3.2A)
MAL  A1401 (-2.6A)
None
None
None
MAL  A1401 (-3.4A)
MAL  A1401 (-2.7A)
MAL  A1401 (-3.0A)
MAL  A1401 (-3.8A)
MAL  A1401 (-4.3A)
 0.50A 3jyrA-4xaiA:
62.1		 3jyrA-4xaiA:
77.21
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3JYR_A_ACRA371_2
(MALTOSE-BINDING
PERIPLASMIC PROTEIN)		 4xai MALTOSE-BINDING
PERIPLASMIC
PROTEIN,TAILLESS
ORTHOLOG
(Escherichia
coli;
Tribolium
castaneum) 		6 / 7 ASN A  14
TRP A  64
GLU A 155
TYR A 157
MET A 332
TRP A 342
 MAL  A1401 (-4.6A)
MAL  A1401 (-4.5A)
MAL  A1401 (-3.7A)
MAL  A1401 (-3.8A)
MAL  A1401 ( 4.4A)
MAL  A1401 (-3.7A)
 0.27A 3jyrA-4xaiA:
62.1		 3jyrA-4xaiA:
77.21
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.
3RV5_A_DXCA91_0
(TROPONIN C, SLOW
SKELETAL AND CARDIAC
MUSCLES)		 4xai MALTOSE-BINDING
PERIPLASMIC
PROTEIN,TAILLESS
ORTHOLOG
GRUNGE, ISOFORM J
(Escherichia
coli;
Tribolium
castaneum;
Drosophila
melanogaster) 		3 / 3 PHE A1379
GLN P1822
PHE A1240
 None
 0.80A 3rv5A-4xaiA:
1.9		 3rv5A-4xaiA:
10.93
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.
3VYW_D_SAMD401_1
(MNMC2)		 4xai MALTOSE-BINDING
PERIPLASMIC
PROTEIN,TAILLESS
ORTHOLOG
(Escherichia
coli;
Tribolium
castaneum) 		4 / 5 GLU A 310
ASP A 316
ASP A 289
ASN A 296
 None
 1.32A 3vywD-4xaiA:
undetectable		 3vywD-4xaiA:
21.00
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.
4N48_A_SAMA601_1
(CAP-SPECIFIC MRNA
(NUCLEOSIDE-2'-O-)-M
ETHYLTRANSFERASE 1)		 4xai MALTOSE-BINDING
PERIPLASMIC
PROTEIN,TAILLESS
ORTHOLOG
(Escherichia
coli;
Tribolium
castaneum) 		4 / 5 ASN A 269
ALA A  53
GLY A  58
ASP A  16
 None
None
None
MAL  A1401 (-3.2A)
 1.01A 4n48A-4xaiA:
undetectable		 4n48A-4xaiA:
22.54
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.
4P65_K_IPHK101_0
(INSULIN)		 4xai MALTOSE-BINDING
PERIPLASMIC
PROTEIN,TAILLESS
ORTHOLOG
(Escherichia
coli;
Tribolium
castaneum) 		5 / 12 LEU A 117
ILE A 134
LEU A 141
LEU A 124
ALA A 225
 None
 1.05A 4p65F-4xaiA:
undetectable
4p65H-4xaiA:
undetectable
4p65K-4xaiA:
undetectable
4p65L-4xaiA:
undetectable		 4p65F-4xaiA:
4.06
4p65H-4xaiA:
4.06
4p65K-4xaiA:
3.23
4p65L-4xaiA:
4.06
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.
5DV4_A_NMYA601_2
(CCR4-NOT
TRANSCRIPTION
COMPLEX SUBUNIT
6-LIKE)		 4xai MALTOSE-BINDING
PERIPLASMIC
PROTEIN,TAILLESS
ORTHOLOG
(Escherichia
coli;
Tribolium
castaneum) 		3 / 3 GLU A  47
TRP A 342
ASN A  14
 None
MAL  A1401 (-3.7A)
MAL  A1401 (-4.6A)
 0.99A 5dv4A-4xaiA:
undetectable		 5dv4A-4xaiA:
21.24
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.
5E4D_B_BEZB203_0
(HYDROXYNITRILE LYASE)		 4xai MALTOSE-BINDING
PERIPLASMIC
PROTEIN,TAILLESS
ORTHOLOG
(Escherichia
coli;
Tribolium
castaneum) 		4 / 4 VAL A 112
ALA A 114
ILE A 319
THR A 322
 None
 1.20A 5e4dB-4xaiA:
undetectable		 5e4dB-4xaiA:
16.31
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5HBS_A_RTLA201_1
(RETINOL-BINDING
PROTEIN 1)		 4xai MALTOSE-BINDING
PERIPLASMIC
PROTEIN,TAILLESS
ORTHOLOG
(Escherichia
coli;
Tribolium
castaneum) 		4 / 8 LEU A1223
LEU A1230
THR A1308
GLN A1337
 None
 1.18A 5hbsA-4xaiA:
undetectable		 5hbsA-4xaiA:
13.67
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.
5IK1_A_CAMA502_0
(CAMPHOR
5-MONOOXYGENASE)		 4xai MALTOSE-BINDING
PERIPLASMIC
PROTEIN,TAILLESS
ORTHOLOG
(Escherichia
coli;
Tribolium
castaneum) 		4 / 5 PHE A1280
LEU A1248
GLY A1243
ILE A1369
 None
 0.86A 5ik1A-4xaiA:
1.8		 5ik1A-4xaiA:
21.11
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.
5W4Z_A_RBFA502_1
(RIBOFLAVIN LYASE)		 4xai MALTOSE-BINDING
PERIPLASMIC
PROTEIN,TAILLESS
ORTHOLOG
(Escherichia
coli;
Tribolium
castaneum) 		6 / 12 ALA A 344
ALA A 340
GLY A 168
ALA A 190
PHE A 171
VAL A 183
 None
 1.48A 5w4zA-4xaiA:
undetectable		 5w4zA-4xaiA:
8.53
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.
5W4Z_B_RBFB502_1
(RIBOFLAVIN LYASE)		 4xai MALTOSE-BINDING
PERIPLASMIC
PROTEIN,TAILLESS
ORTHOLOG
(Escherichia
coli;
Tribolium
castaneum) 		6 / 12 ALA A 344
ALA A 340
GLY A 168
ALA A 190
PHE A 171
VAL A 183
 None
 1.50A 5w4zB-4xaiA:
undetectable		 5w4zB-4xaiA:
8.53
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.
5Z12_C_9CRC501_1
(RETINOIC ACID
RECEPTOR RXR-ALPHA)		 4xai GRUNGE, ISOFORM J
MALTOSE-BINDING
PERIPLASMIC
PROTEIN,TAILLESS
ORTHOLOG
(Drosophila
melanogaster;
Escherichia
coli;
Tribolium
castaneum) 		5 / 12 ALA A1204
ALA A1203
GLN A1205
LEU P1820
ALA P1819
 None
 0.80A 5z12C-4xaiA:
15.7		 5z12C-4xaiA:
10.02
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.
6B58_A_ACTA603_0
(FUMARATE REDUCTASE
FLAVOPROTEIN SUBUNIT)		 4xai MALTOSE-BINDING
PERIPLASMIC
PROTEIN,TAILLESS
ORTHOLOG
(Escherichia
coli;
Tribolium
castaneum) 		3 / 3 TYR A 157
ASN A 229
LEU A 115
 MAL  A1401 (-3.8A)
None
None
 0.82A 6b58A-4xaiA:
undetectable		 6b58A-4xaiA:
21.55
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.
6BM5_A_SAMA1301_0
(METHIONINE SYNTHASE)		 4xai MALTOSE-BINDING
PERIPLASMIC
PROTEIN,TAILLESS
ORTHOLOG
(Escherichia
coli;
Tribolium
castaneum) 		5 / 11 PRO A 135
GLU A 132
PRO A 256
ALA A 165
PRO A 161
 None
 1.47A 6bm5A-4xaiA:
undetectable		 6bm5A-4xaiA:
21.57