SIMILAR PATTERNS OF AMINO ACIDS FOR 1Q23_A_FUAA702_1

List of similar pattern of amino acids derived from ASSAM search

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 link on the last column to view superposed patterns of amino acids in NGL viewer)
(Note that only 3-12 residue patterns can be used for ASSAM searches)
Filter list by:
Hit Macromolecule/
Organism		 Pfam Res. 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.
1a59 CITRATE SYNTHASE

(Antarctic
bacterium
DS2-3R) 		PF00285
(Citrate_synt) 		5 PHE A 164
LEU A 160
VAL A 173
ALA A 285
ALA A 175
 None
 1.19A 1q23A-1a59A:
0.0
1q23B-1a59A:
undetectable		 1q23A-1a59A:
19.37
1q23B-1a59A:
19.37
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.
1b8a PROTEIN
(ASPARTYL-TRNA
SYNTHETASE)

(Thermococcus
kodakarensis) 		PF00152
(tRNA-synt_2)
PF01336
(tRNA_anti-codon) 		5 SER A 363
PHE A 327
LEU A 325
ALA A 146
ALA A 254
 None
 1.23A 1q23A-1b8aA:
0.9
1q23B-1b8aA:
0.9		 1q23A-1b8aA:
18.37
1q23B-1b8aA:
18.37
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1cia CHLORAMPHENICOL
ACETYLTRANSFERASE

(Escherichia
coli) 		PF00302
(CAT) 		5 THR A  94
PHE A 135
PHE A 158
LEU A 160
VAL A 162
 None
 0.57A 1q23A-1ciaA:
32.4
1q23B-1ciaA:
32.2		 1q23A-1ciaA:
44.95
1q23B-1ciaA:
44.95
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.
1h7w DIHYDROPYRIMIDINE
DEHYDROGENASE

(Sus scrofa) 		PF01180
(DHO_dh)
PF07992
(Pyr_redox_2)
PF14691
(Fer4_20)
PF14697
(Fer4_21) 		5 PHE A 234
PHE A 387
LEU A 361
VAL A 337
ALA A 351
 None
 1.28A 1q23A-1h7wA:
0.0
1q23B-1h7wA:
0.0		 1q23A-1h7wA:
11.35
1q23B-1h7wA:
11.35
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.
1hds HEMOGLOBIN S (DEOXY)
(ALPHA CHAIN)
HEMOGLOBIN S (DEOXY)
(BETA CHAIN)

(Odocoileus
virginianus) 		PF00042
(Globin) 		5 PHE B  70
PHE B 129
VAL A 107
PHE B 121
ALA B  26
 None
 1.31A 1q23A-1hdsB:
undetectable
1q23B-1hdsB:
undetectable		 1q23A-1hdsB:
20.71
1q23B-1hdsB:
20.71
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.
1i5g TRYPAREDOXIN II

(Crithidia
fasciculata) 		PF13905
(Thioredoxin_8) 		5 PHE A   8
VAL A 116
PHE A  34
ALA A  28
ALA A 118
 None
 1.24A 1q23A-1i5gA:
undetectable
1q23B-1i5gA:
undetectable		 1q23A-1i5gA:
21.23
1q23B-1i5gA:
21.23
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.
1i84 SMOOTH MUSCLE MYOSIN
HEAVY CHAIN

(Gallus gallus) 		PF00063
(Myosin_head)
PF00612
(IQ)
PF01576
(Myosin_tail_1)
PF02736
(Myosin_N) 		5 PHE S 315
LEU S 613
VAL S 609
PHE S 398
ALA S 429
 None
 1.30A 1q23A-1i84S:
0.0
1q23B-1i84S:
0.0		 1q23A-1i84S:
10.17
1q23B-1i84S:
10.17
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.
1iiu PLASMA
RETINOL-BINDING
PROTEIN

(Gallus gallus) 		PF00061
(Lipocalin) 		5 PHE A  77
LEU A  37
VAL A  41
PHE A 135
ALA A  43
 None
RTL  A 176 ( 4.5A)
None
RTL  A 176 ( 4.2A)
RTL  A 176 ( 4.1A)
 1.05A 1q23A-1iiuA:
undetectable
1q23B-1iiuA:
0.0		 1q23A-1iiuA:
21.10
1q23B-1iiuA:
21.10
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.
1mo2 ERYTHRONOLIDE
SYNTHASE, MODULES 5
AND 6

(Saccharopolyspora
erythraea) 		PF00975
(Thioesterase) 		5 LEU A  56
VAL A 122
PHE A  48
ALA A 150
ALA A 120
 None
 0.98A 1q23A-1mo2A:
0.0
1q23B-1mo2A:
0.0		 1q23A-1mo2A:
19.67
1q23B-1mo2A:
19.67
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.
1ogd HIGH AFFINITY RIBOSE
TRANSPORT PROTEIN
RBSD

(Bacillus
subtilis) 		PF05025
(RbsD_FucU) 		5 THR A 114
LEU A 125
VAL A  67
ALA A  70
ALA A  69
 None
 1.22A 1q23A-1ogdA:
undetectable
1q23B-1ogdA:
0.0		 1q23A-1ogdA:
20.56
1q23B-1ogdA:
20.56
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1pd5 CHLORAMPHENICOL
ACETYLTRANSFERASE

(Escherichia
coli) 		PF00302
(CAT) 		9 THR A  93
TYR A 133
PHE A 134
PHE A 144
SER A 146
PHE A 156
LEU A 158
VAL A 160
PHE A 166
 None
 0.49A 1q23A-1pd5A:
37.1
1q23B-1pd5A:
35.8		 1q23A-1pd5A:
100.00
1q23B-1pd5A:
100.00
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.
1pjm IMPORTIN ALPHA-2
SUBUNIT

(Mus musculus) 		PF00514
(Arm)
PF16186
(Arm_3) 		5 PHE B 127
PHE B 167
LEU B 144
ALA B  99
ALA B 100
 None
 1.31A 1q23A-1pjmB:
undetectable
1q23B-1pjmB:
undetectable		 1q23A-1pjmB:
18.36
1q23B-1pjmB:
18.36
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.
1tue REPLICATION PROTEIN
E1

(Alphapapillomavirus
7) 		PF00519
(PPV_E1_C) 		5 THR A 591
PHE A 482
PHE A 463
LEU A 627
PHE A 619
 None
 1.06A 1q23A-1tueA:
undetectable
1q23B-1tueA:
undetectable		 1q23A-1tueA:
22.54
1q23B-1tueA:
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.
1twd COPPER HOMEOSTASIS
PROTEIN CUTC

(Shigella
flexneri) 		PF03932
(CutC) 		5 THR A  92
LEU A  43
VAL A  42
ALA A  30
ALA A  29
 None
 1.26A 1q23A-1twdA:
undetectable
1q23B-1twdA:
undetectable		 1q23A-1twdA:
20.00
1q23B-1twdA:
20.00
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.
1w45 ANNEXIN A8

(Homo sapiens) 		PF00191
(Annexin) 		5 THR A 275
TYR A 257
PHE A 258
LEU A 102
ALA A 121
 None
 1.34A 1q23A-1w45A:
undetectable
1q23B-1w45A:
undetectable		 1q23A-1w45A:
20.48
1q23B-1w45A:
20.48
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.
1wmr ISOPULLULANASE

(Aspergillus
niger) 		PF03718
(Glyco_hydro_49)
PF17433
(Glyco_hydro_49N) 		5 TYR A  55
SER A 121
LEU A 162
ALA A  98
ALA A 176
 None
 1.34A 1q23A-1wmrA:
undetectable
1q23B-1wmrA:
undetectable		 1q23A-1wmrA:
16.01
1q23B-1wmrA:
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.
1yq1 GLUTATHIONE
S-TRANSFERASE

(Caenorhabditis
elegans) 		PF02798
(GST_N)
PF14497
(GST_C_3) 		5 PHE A  60
LEU A  55
PHE A  22
ALA A  79
ALA A  73
 None
 1.20A 1q23A-1yq1A:
undetectable
1q23B-1yq1A:
undetectable		 1q23A-1yq1A:
23.89
1q23B-1yq1A:
23.89
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.
2asn NITROPHORIN 2

(Rhodnius
prolixus) 		PF02087
(Nitrophorin) 		5 PHE X 162
LEU X 106
VAL X 108
ALA X 155
HIS X 119
 None
 1.21A 1q23A-2asnX:
undetectable
1q23B-2asnX:
undetectable		 1q23A-2asnX:
20.09
1q23B-2asnX:
20.09
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.
2cc1 BETA-LACTAMASE

(Mycolicibacterium
fortuitum) 		PF13354
(Beta-lactamase2) 		5 LEU A 139
VAL A  76
PHE A  72
ALA A 125
ALA A 126
 None
 1.31A 1q23A-2cc1A:
undetectable
1q23B-2cc1A:
undetectable		 1q23A-2cc1A:
17.98
1q23B-2cc1A:
17.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2e7t BASIC AGGLUTININ

(Psophocarpus
tetragonolobus) 		PF00139
(Lectin_legB) 		5 PHE A 107
LEU A 177
VAL A 162
PHE A  74
ALA A 120
 None
 1.22A 1q23A-2e7tA:
undetectable
1q23B-2e7tA:
undetectable		 1q23A-2e7tA:
21.65
1q23B-2e7tA:
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.
2euh NADP DEPENDENT NON
PHOSPHORYLATING
GLYCERALDEHYDE-3-PHO
SPHATE DEHYDROGENASE

(Streptococcus
mutans) 		PF00171
(Aldedh) 		5 SER A 151
LEU A 189
PHE A 203
ALA A 111
ALA A 165
 None
 1.25A 1q23A-2euhA:
undetectable
1q23B-2euhA:
undetectable		 1q23A-2euhA:
18.67
1q23B-2euhA:
18.67
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.
2g0y PENTAPEPTIDE REPEAT
PROTEIN

(Cyanothece sp.
ATCC 51142) 		PF00805
(Pentapeptide) 		5 PHE A  39
LEU A  64
PHE A  49
ALA A   7
ALA A  27
 None
 1.34A 1q23A-2g0yA:
undetectable
1q23B-2g0yA:
undetectable		 1q23A-2g0yA:
20.00
1q23B-2g0yA:
20.00
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.
2h2w HOMOSERINE
O-SUCCINYLTRANSFERAS
E

(Thermotoga
maritima) 		PF04204
(HTS) 		5 PHE A 115
LEU A 207
VAL A 221
ALA A 144
ALA A 145
 None
 1.17A 1q23A-2h2wA:
undetectable
1q23B-2h2wA:
undetectable		 1q23A-2h2wA:
20.31
1q23B-2h2wA:
20.31
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.
2hk3 DIPHOSPHOMEVALONATE
DECARBOXYLASE

(Staphylococcus
aureus) 		PF00288
(GHMP_kinases_N)
PF08544
(GHMP_kinases_C) 		6 THR A  43
PHE A  41
SER A 109
PHE A 180
ALA A 101
ALA A 102
 None
 1.40A 1q23A-2hk3A:
undetectable
1q23B-2hk3A:
undetectable		 1q23A-2hk3A:
21.82
1q23B-2hk3A:
21.82
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.
2ihm DNA POLYMERASE MU

(Mus musculus) 		PF10391
(DNA_pol_lambd_f)
PF14716
(HHH_8)
PF14791
(DNA_pol_B_thumb)
PF14792
(DNA_pol_B_palm) 		5 LEU A 189
VAL A 185
PHE A 205
ALA A 183
HIS A 151
 None
 1.27A 1q23A-2ihmA:
undetectable
1q23B-2ihmA:
undetectable		 1q23A-2ihmA:
18.80
1q23B-2ihmA:
18.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2n50 ACYL CARRIER PROTEIN

(Enterococcus
faecalis) 		PF00550
(PP-binding) 		5 SER A  15
VAL A   6
PHE A  53
ALA A  70
ALA A  71
 None
 1.34A 1q23A-2n50A:
undetectable
1q23B-2n50A:
undetectable		 1q23A-2n50A:
15.07
1q23B-2n50A:
15.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2nym SERINE/THREONINE-PRO
TEIN PHOSPHATASE 2A
CATALYTIC SUBUNIT
ALPHA ISOFORM

(Homo sapiens) 		PF00149
(Metallophos) 		5 THR C  53
PHE C 286
PHE C 289
VAL C 244
ALA C 240
 None
 1.30A 1q23A-2nymC:
undetectable
1q23B-2nymC:
undetectable		 1q23A-2nymC:
20.78
1q23B-2nymC:
20.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2oqh PUTATIVE ISOMERASE

(Streptomyces
coelicolor) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		5 TYR A 272
LEU A 120
VAL A 116
ALA A 305
ALA A 308
 None
 1.25A 1q23A-2oqhA:
undetectable
1q23B-2oqhA:
undetectable		 1q23A-2oqhA:
18.68
1q23B-2oqhA:
18.68
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.
2vp1 PERIPLASMIC
IRON-BINDING PROTEIN

(Synechocystis
sp. PCC 6803) 		PF13343
(SBP_bac_6) 		5 TYR A 293
PHE A 294
PHE A  84
LEU A  59
VAL A  57
 None
 1.13A 1q23A-2vp1A:
undetectable
1q23B-2vp1A:
undetectable		 1q23A-2vp1A:
18.08
1q23B-2vp1A:
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.
2w2k D-MANDELATE
DEHYDROGENASE

(Rhodotorula
graminis) 		PF00389
(2-Hacid_dh)
PF02826
(2-Hacid_dh_C) 		5 PHE B 129
PHE B 242
LEU B 217
VAL B 191
ALA B 182
 None
 1.26A 1q23A-2w2kB:
undetectable
1q23B-2w2kB:
undetectable		 1q23A-2w2kB:
21.08
1q23B-2w2kB:
21.08
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.
3a0g HEMOGLOBIN SUBUNIT
ALPHA
HEMOGLOBIN SUBUNIT
BETA

(Cavia porcellus) 		PF00042
(Globin) 		5 PHE B  71
PHE B 130
PHE A  36
PHE B 122
ALA B  27
 None
 1.19A 1q23A-3a0gB:
undetectable
1q23B-3a0gB:
undetectable		 1q23A-3a0gB:
22.11
1q23B-3a0gB:
22.11
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.
3a0g HEMOGLOBIN SUBUNIT
ALPHA
HEMOGLOBIN SUBUNIT
BETA

(Cavia porcellus) 		PF00042
(Globin) 		5 PHE B 130
VAL A 107
PHE B 122
ALA B  27
ALA B 113
 None
 1.27A 1q23A-3a0gB:
undetectable
1q23B-3a0gB:
undetectable		 1q23A-3a0gB:
22.11
1q23B-3a0gB:
22.11
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.
3bj5 PROTEIN
DISULFIDE-ISOMERASE

(Homo sapiens) 		PF13848
(Thioredoxin_6) 		5 THR A 302
PHE A 232
PHE A 288
PHE A 243
ALA A 272
 None
 1.29A 1q23A-3bj5A:
undetectable
1q23B-3bj5A:
undetectable		 1q23A-3bj5A:
19.63
1q23B-3bj5A:
19.63
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.
3c5c RAS-LIKE PROTEIN 12

(Homo sapiens) 		PF00071
(Ras) 		5 LEU A 132
VAL A 175
PHE A 176
ALA A 183
ALA A 179
 None
 1.28A 1q23A-3c5cA:
undetectable
1q23B-3c5cA:
undetectable		 1q23A-3c5cA:
21.19
1q23B-3c5cA:
21.19
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.
3cmm UBIQUITIN-ACTIVATING
ENZYME E1 1

(Saccharomyces
cerevisiae) 		PF00899
(ThiF)
PF09358
(E1_UFD)
PF10585
(UBA_e1_thiolCys)
PF16190
(E1_FCCH)
PF16191
(E1_4HB) 		5 THR A 870
PHE A 483
LEU A 439
VAL A 468
ALA A 498
 None
 1.35A 1q23A-3cmmA:
undetectable
1q23B-3cmmA:
undetectable		 1q23A-3cmmA:
11.75
1q23B-3cmmA:
11.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3cq5 HISTIDINOL-PHOSPHATE
AMINOTRANSFERASE

(Corynebacterium
glutamicum) 		PF00155
(Aminotran_1_2) 		5 PHE A 315
PHE A 325
LEU A 355
VAL A 291
ALA A 301
 None
 1.30A 1q23A-3cq5A:
undetectable
1q23B-3cq5A:
undetectable		 1q23A-3cq5A:
22.56
1q23B-3cq5A:
22.56
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.
3fbg PUTATIVE ARGINATE
LYASE

(Staphylococcus
haemolyticus) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		5 THR A 129
PHE A 138
LEU A 152
VAL A 176
ALA A 158
 None
 1.34A 1q23A-3fbgA:
undetectable
1q23B-3fbgA:
undetectable		 1q23A-3fbgA:
18.99
1q23B-3fbgA:
18.99
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.
3fob BROMOPEROXIDASE

(Bacillus
anthracis) 		PF00561
(Abhydrolase_1) 		5 PHE A  98
SER A 228
VAL A 178
ALA A 262
HIS A 264
 None
 1.30A 1q23A-3fobA:
undetectable
1q23B-3fobA:
undetectable		 1q23A-3fobA:
19.86
1q23B-3fobA:
19.86
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.
3fy4 6-4 PHOTOLYASE

(Arabidopsis
thaliana) 		PF00875
(DNA_photolyase)
PF03441
(FAD_binding_7) 		5 TYR A 437
PHE A 441
VAL A 259
PHE A 218
ALA A 366
 None
None
FAD  A 900 (-3.8A)
None
None
 1.24A 1q23A-3fy4A:
undetectable
1q23B-3fy4A:
undetectable		 1q23A-3fy4A:
16.54
1q23B-3fy4A:
16.54
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.
3g7k 3-METHYLITACONATE
ISOMERASE

(Eubacterium
barkeri) 		PF04303
(PrpF) 		5 THR A 129
PHE A 261
PHE A  80
ALA A 307
ALA A 304
 None
 1.22A 1q23A-3g7kA:
undetectable
1q23B-3g7kA:
undetectable		 1q23A-3g7kA:
18.60
1q23B-3g7kA:
18.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3jxt DISKS LARGE HOMOLOG
3

(Rattus
norvegicus) 		PF00595
(PDZ) 		5 PHE A 416
SER A 430
ALA A 461
ALA A 466
HIS A 463
 None
ACT  A   1 (-2.7A)
None
None
None
 1.29A 1q23A-3jxtA:
undetectable
1q23B-3jxtA:
undetectable		 1q23A-3jxtA:
16.44
1q23B-3jxtA:
16.44
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3kz1 RHO GUANINE
NUCLEOTIDE EXCHANGE
FACTOR 11

(Homo sapiens) 		PF00621
(RhoGEF) 		5 SER A 877
LEU A 785
VAL A 828
ALA A 923
ALA A 830
 None
 1.34A 1q23A-3kz1A:
undetectable
1q23B-3kz1A:
undetectable		 1q23A-3kz1A:
19.84
1q23B-3kz1A:
19.84
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.
3oo9 ABC TRANSPORTER
BINDING PROTEIN ACBH

(Actinoplanes
sp. SE50/110) 		PF01547
(SBP_bac_1) 		5 PHE A 183
VAL A 391
PHE A 215
ALA A 399
ALA A 395
 None
 1.21A 1q23A-3oo9A:
undetectable
1q23B-3oo9A:
undetectable		 1q23A-3oo9A:
20.29
1q23B-3oo9A:
20.29
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.
3pj0 LMO0305 PROTEIN

(Listeria
monocytogenes) 		PF01212
(Beta_elim_lyase) 		5 THR A 313
PHE A 273
LEU A 269
VAL A 335
ALA A 338
 None
 1.24A 1q23A-3pj0A:
2.0
1q23B-3pj0A:
undetectable		 1q23A-3pj0A:
21.88
1q23B-3pj0A:
21.88
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.
3pua PHD FINGER PROTEIN 2

(Homo sapiens) 		PF02373
(JmjC) 		5 THR A 325
TYR A 259
PHE A 268
SER A 244
ALA A 333
 None
OGA  A 454 (-4.6A)
None
None
EDO  A   9 ( 3.9A)
 1.29A 1q23A-3puaA:
undetectable
1q23B-3puaA:
undetectable		 1q23A-3puaA:
18.25
1q23B-3puaA:
18.25
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.
3pym GLYCERALDEHYDE-3-PHO
SPHATE DEHYDROGENASE
3

(Saccharomyces
cerevisiae) 		PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C) 		5 PHE A 293
SER A 291
LEU A 243
VAL A 245
ALA A 165
 None
 1.23A 1q23A-3pymA:
undetectable
1q23B-3pymA:
undetectable		 1q23A-3pymA:
18.45
1q23B-3pymA:
18.45
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.
3qgh RNA-DIRECTED RNA
POLYMERASE

(Hepacivirus C) 		PF00998
(RdRP_3) 		5 THR A 229
PHE A 224
SER A 231
VAL A  71
ALA A 299
 None
 1.18A 1q23A-3qghA:
2.2
1q23B-3qghA:
2.2		 1q23A-3qghA:
16.58
1q23B-3qghA:
16.58
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.
3qnt NIEMANN-PICK C1-LIKE
PROTEIN 1

(Homo sapiens) 		PF16414
(NPC1_N) 		5 TYR A 156
PHE A  35
SER A  53
LEU A 103
ALA A 158
 None
 1.05A 1q23A-3qntA:
undetectable
1q23B-3qntA:
undetectable		 1q23A-3qntA:
20.42
1q23B-3qntA:
20.42
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.
3qs1 PLASMEPSIN-1

(Plasmodium
falciparum) 		PF00026
(Asp) 		5 THR A 264
VAL A 214
PHE A 305
ALA A 210
ALA A 212
 None
 1.23A 1q23A-3qs1A:
undetectable
1q23B-3qs1A:
undetectable		 1q23A-3qs1A:
21.39
1q23B-3qs1A:
21.39
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.
3s5s MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME
FAMILY PROTEIN

(Sorangium
cellulosum) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		5 PHE A  58
LEU A 220
VAL A 244
ALA A 250
ALA A 246
 None
 1.30A 1q23A-3s5sA:
undetectable
1q23B-3s5sA:
undetectable		 1q23A-3s5sA:
18.50
1q23B-3s5sA:
18.50
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.
3t6q CD180 ANTIGEN

(Mus musculus) 		PF13855
(LRR_8) 		5 THR A 135
LEU A 106
PHE A  73
ALA A 117
ALA A 120
 None
 1.21A 1q23A-3t6qA:
undetectable
1q23B-3t6qA:
undetectable		 1q23A-3t6qA:
16.92
1q23B-3t6qA:
16.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3v0i VOLTAGE-SENSOR
CONTAINING
PHOSPHATASE

(Ciona
intestinalis) 		PF00782
(DSPc)
PF10409
(PTEN_C2) 		5 PHE A 570
LEU A 568
VAL A 566
PHE A 511
ALA A 413
 None
 1.15A 1q23A-3v0iA:
undetectable
1q23B-3v0iA:
undetectable		 1q23A-3v0iA:
20.62
1q23B-3v0iA:
20.62
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.
3ze6 PERIPLASMIC [NIFESE]
HYDROGENASE, SMALL
SUBUNIT

(Desulfovibrio
vulgaris) 		PF01058
(Oxidored_q6)
PF14720
(NiFe_hyd_SSU_C) 		5 PHE A 203
LEU A 193
VAL A 154
ALA A 122
ALA A 117
 None
 1.34A 1q23A-3ze6A:
undetectable
1q23B-3ze6A:
undetectable		 1q23A-3ze6A:
20.20
1q23B-3ze6A:
20.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3zu4 PUTATIVE REDUCTASE
YPO4104/Y4119/YP_401
1

(Yersinia pestis) 		PF07055
(Eno-Rase_FAD_bd)
PF12241
(Enoyl_reductase)
PF12242
(Eno-Rase_NADH_b) 		5 THR A 192
SER A 239
LEU A 181
ALA A 278
ALA A 281
 None
 1.25A 1q23A-3zu4A:
undetectable
1q23B-3zu4A:
undetectable		 1q23A-3zu4A:
19.04
1q23B-3zu4A:
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.
3zwf ZINC
PHOSPHODIESTERASE
ELAC PROTEIN 1

(Homo sapiens) 		PF00753
(Lactamase_B)
PF12706
(Lactamase_B_2) 		5 PHE A 300
PHE A 178
VAL A 192
ALA A 306
ALA A 269
 None
 1.33A 1q23A-3zwfA:
undetectable
1q23B-3zwfA:
undetectable		 1q23A-3zwfA:
20.05
1q23B-3zwfA:
20.05
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.
4bi3 SSP1

(Serratia
marcescens) 		PF14113
(Tae4) 		5 SER A  14
LEU A 136
VAL A 120
ALA A  85
HIS A 133
 None
None
None
None
K  A1167 ( 4.9A)
 1.32A 1q23A-4bi3A:
undetectable
1q23B-4bi3A:
undetectable		 1q23A-4bi3A:
19.14
1q23B-4bi3A:
19.14
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.
4cj0 ENDOGLUCANASE D

(Ruminiclostridium
thermocellum) 		PF00759
(Glyco_hydro_9)
PF02927
(CelD_N) 		5 PHE A 398
LEU A 431
VAL A 472
PHE A 409
ALA A 486
 None
 1.35A 1q23A-4cj0A:
undetectable
1q23B-4cj0A:
undetectable		 1q23A-4cj0A:
15.26
1q23B-4cj0A:
15.26
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.
4dnh UNCHARACTERIZED
PROTEIN

(Sinorhizobium
meliloti) 		PF06187
(DUF993) 		5 THR A 309
PHE A 302
LEU A 291
ALA A  41
ALA A  40
 None
 1.31A 1q23A-4dnhA:
undetectable
1q23B-4dnhA:
undetectable		 1q23A-4dnhA:
17.51
1q23B-4dnhA:
17.51
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.
4dun PUTATIVE PHENAZINE
BIOSYNTHESIS
PHZC/PHZF PROTEIN

(Clostridioides
difficile) 		PF02567
(PhzC-PhzF) 		5 THR A  95
PHE A  93
PHE A 113
ALA A  19
ALA A  75
 None
 1.29A 1q23A-4dunA:
undetectable
1q23B-4dunA:
undetectable		 1q23A-4dunA:
22.38
1q23B-4dunA:
22.38
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.
4f8a POTASSIUM
VOLTAGE-GATED
CHANNEL SUBFAMILY H
MEMBER 1

(Mus musculus) 		PF00027
(cNMP_binding) 		5 PHE A 691
SER A 690
VAL A 575
PHE A 620
ALA A 592
 None
 1.31A 1q23A-4f8aA:
undetectable
1q23B-4f8aA:
undetectable		 1q23A-4f8aA:
22.77
1q23B-4f8aA:
22.77
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.
4fdj N-ACETYLGALACTOSAMIN
E-6-SULFATASE

(Homo sapiens) 		PF00884
(Sulfatase)
PF14707
(Sulfatase_C) 		5 THR A 348
SER A 349
PHE A 227
ALA A  75
ALA A  85
 None
 1.06A 1q23A-4fdjA:
undetectable
1q23B-4fdjA:
undetectable		 1q23A-4fdjA:
15.49
1q23B-4fdjA:
15.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4g1p CYS-GLY
METALLODIPEPTIDASE
DUG1

(Saccharomyces
cerevisiae) 		PF01546
(Peptidase_M20)
PF07687
(M20_dimer) 		5 SER A 144
VAL A 409
PHE A   9
ALA A 402
ALA A 405
 None
 1.34A 1q23A-4g1pA:
2.9
1q23B-4g1pA:
2.7		 1q23A-4g1pA:
17.76
1q23B-4g1pA:
17.76
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.
4h0m C-PHYCOCYANIN ALPHA
CHAIN
C-PHYCOCYANIN BETA
CHAIN

(Synechococcus
elongatus) 		PF00502
(Phycobilisome) 		5 THR B  40
TYR B 163
PHE A  31
LEU B  30
ALA B 102
 CYC  B 202 ( 4.7A)
None
None
None
None
 1.34A 1q23A-4h0mB:
undetectable
1q23B-4h0mB:
undetectable		 1q23A-4h0mB:
24.68
1q23B-4h0mB:
24.68
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.
4h5g AMINO ACID ABC
SUPERFAMILY ATP
BINDING CASSETTE
TRANSPORTER, BINDING
PROTEIN

(Streptococcus
pneumoniae) 		PF00497
(SBP_bac_3) 		5 SER A 236
LEU A 105
VAL A 107
ALA A 112
ALA A 229
 ACT  A 305 ( 4.6A)
None
None
None
None
 1.17A 1q23A-4h5gA:
undetectable
1q23B-4h5gA:
undetectable		 1q23A-4h5gA:
20.54
1q23B-4h5gA:
20.54
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.
4hj2 GLUTATHIONE
S-TRANSFERASE A1

(Homo sapiens) 		PF00043
(GST_C)
PF02798
(GST_N) 		5 THR A  68
TYR A   9
LEU A 108
VAL A 111
ALA A  12
 LZ6  A 301 (-3.5A)
LZ6  A 301 (-4.6A)
None
None
None
 1.19A 1q23A-4hj2A:
undetectable
1q23B-4hj2A:
undetectable		 1q23A-4hj2A:
17.96
1q23B-4hj2A:
17.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4mnp N-ACETYLNEURAMINATE-
BINDING PROTEIN

(Fusobacterium
nucleatum) 		PF03480
(DctP) 		5 PHE A  92
VAL A 119
PHE A 108
ALA A 243
ALA A 121
 None
 1.29A 1q23A-4mnpA:
undetectable
1q23B-4mnpA:
undetectable		 1q23A-4mnpA:
18.40
1q23B-4mnpA:
18.40
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.
4mr0 PLASMIN AND
FIBRONECTIN-BINDING
PROTEIN A

(Streptococcus
pneumoniae) 		PF12708
(Pectate_lyase_3)
PF13229
(Beta_helix) 		5 PHE A 189
SER A 253
ALA A 179
ALA A 178
HIS A 207
 None
 1.31A 1q23A-4mr0A:
undetectable
1q23B-4mr0A:
undetectable		 1q23A-4mr0A:
14.81
1q23B-4mr0A:
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.
4nhd 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
SYNTHASE 3 PROTEIN 1

(Vibrio cholerae) 		PF08541
(ACP_syn_III_C)
PF08545
(ACP_syn_III) 		5 THR A 278
SER A 275
LEU A 189
VAL A 211
ALA A 215
 None
SCY  A 112 ( 3.3A)
COA  A 401 (-4.2A)
COA  A 401 (-3.9A)
None
 1.34A 1q23A-4nhdA:
undetectable
1q23B-4nhdA:
undetectable		 1q23A-4nhdA:
21.97
1q23B-4nhdA:
21.97
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.
4ovj EXTRACELLULAR
SOLUTE-BINDING
PROTEIN FAMILY 1

(Alicyclobacillus
acidocaldarius) 		PF13416
(SBP_bac_8) 		5 PHE A 379
LEU A 366
VAL A 344
ALA A  66
ALA A 349
 None
 1.30A 1q23A-4ovjA:
undetectable
1q23B-4ovjA:
undetectable		 1q23A-4ovjA:
18.87
1q23B-4ovjA:
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.
4ozy POLY(BETA-D-MANNURON
ATE) C5 EPIMERASE

(Pseudomonas
syringae group
genomosp. 3) 		PF13229
(Beta_helix) 		5 PHE A 227
LEU A 185
VAL A 208
ALA A 219
ALA A 210
 None
 1.07A 1q23A-4ozyA:
undetectable
1q23B-4ozyA:
undetectable		 1q23A-4ozyA:
21.61
1q23B-4ozyA:
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.
4tm5 D-AMINO ACID
AMINOTRANSFERASE

(Burkholderia
thailandensis) 		PF01063
(Aminotran_4) 		5 LEU A  23
VAL A  10
PHE A 131
ALA A 105
ALA A 134
 None
 1.34A 1q23A-4tm5A:
undetectable
1q23B-4tm5A:
undetectable		 1q23A-4tm5A:
19.61
1q23B-4tm5A:
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.
4u1a ENOYL-COA DELTA
ISOMERASE 2

(Homo sapiens) 		PF00378
(ECH_1) 		5 THR A 251
SER A 248
PHE A 237
PHE A 192
ALA A 205
 None
 1.28A 1q23A-4u1aA:
undetectable
1q23B-4u1aA:
undetectable		 1q23A-4u1aA:
22.07
1q23B-4u1aA:
22.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4y85 MITOGEN-ACTIVATED
PROTEIN KINASE
KINASE KINASE 8

(Homo sapiens) 		PF00069
(Pkinase) 		5 PHE A 271
LEU A 268
VAL A 237
ALA A 380
ALA A 379
 None
 1.32A 1q23A-4y85A:
undetectable
1q23B-4y85A:
undetectable		 1q23A-4y85A:
20.80
1q23B-4y85A:
20.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4yxt POLYKETIDE
BIOSYNTHESIS
3-HYDROXY-3-METHYLGL
UTARYL-ACP SYNTHASE
PKSG

(Bacillus
subtilis) 		PF01154
(HMG_CoA_synt_N)
PF08540
(HMG_CoA_synt_C) 		5 THR A 340
PHE A 184
VAL A 177
PHE A 121
ALA A   4
 None
 1.32A 1q23A-4yxtA:
undetectable
1q23B-4yxtA:
undetectable		 1q23A-4yxtA:
19.24
1q23B-4yxtA:
19.24
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.
4zrs ESTERASE

(uncultured
bacterium) 		PF07859
(Abhydrolase_3) 		5 TYR A 184
PHE A 234
SER A 227
ALA A 158
ALA A 154
 None
SEB  A 151 ( 4.5A)
None
None
SEB  A 151 ( 3.3A)
 1.28A 1q23A-4zrsA:
undetectable
1q23B-4zrsA:
undetectable		 1q23A-4zrsA:
19.38
1q23B-4zrsA:
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.
4zv4 ELONGATION FACTOR TU

(Pseudomonas
aeruginosa) 		PF00009
(GTP_EFTU)
PF03143
(GTP_EFTU_D3)
PF03144
(GTP_EFTU_D2) 		5 PHE A 134
LEU A 199
VAL A 196
ALA A  30
HIS A  79
 None
 1.28A 1q23A-4zv4A:
undetectable
1q23B-4zv4A:
undetectable		 1q23A-4zv4A:
18.29
1q23B-4zv4A:
18.29
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.
5d68 KREV INTERACTION
TRAPPED PROTEIN 1

(Homo sapiens) 		PF00373
(FERM_M)
PF13857
(Ank_5) 		5 TYR A 683
LEU A 669
VAL A 660
PHE A 697
HIS A 668
 None
 1.27A 1q23A-5d68A:
undetectable
1q23B-5d68A:
undetectable		 1q23A-5d68A:
19.45
1q23B-5d68A:
19.45
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.
5d6n ACYL-COA SYNTHASE

(Mycolicibacterium
smegmatis) 		PF00501
(AMP-binding) 		5 PHE A 286
LEU A 267
VAL A 307
PHE A 334
ALA A 309
 None
 1.21A 1q23A-5d6nA:
undetectable
1q23B-5d6nA:
undetectable		 1q23A-5d6nA:
15.98
1q23B-5d6nA:
15.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ey8 ACYL-COA SYNTHASE

(Mycolicibacterium
smegmatis) 		PF00501
(AMP-binding) 		5 PHE A 286
LEU A 267
VAL A 307
PHE A 334
ALA A 309
 None
 1.32A 1q23A-5ey8A:
undetectable
1q23B-5ey8A:
undetectable		 1q23A-5ey8A:
13.88
1q23B-5ey8A:
13.88
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.
5fcl CRISPR-ASSOCIATED
ENDONUCLEASE CAS1

(Pectobacterium
atrosepticum) 		PF01867
(Cas_Cas1) 		5 PHE A 123
LEU A 270
VAL A 140
ALA A 132
ALA A 136
 None
 1.03A 1q23A-5fclA:
undetectable
1q23B-5fclA:
undetectable		 1q23A-5fclA:
20.54
1q23B-5fclA:
20.54
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.
5gkv ESTERASE A

(Caulobacter
vibrioides) 		PF00144
(Beta-lactamase) 		5 THR A  69
SER A 329
LEU A 300
VAL A 299
PHE A 229
 None
 1.22A 1q23A-5gkvA:
undetectable
1q23B-5gkvA:
undetectable		 1q23A-5gkvA:
20.94
1q23B-5gkvA:
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.
5hpl RSP5

(Saccharomyces
cerevisiae) 		PF00632
(HECT) 		5 PHE A 435
LEU A 687
VAL A 556
PHE A 667
ALA A 447
 None
 1.29A 1q23A-5hplA:
undetectable
1q23B-5hplA:
undetectable		 1q23A-5hplA:
18.95
1q23B-5hplA:
18.95
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.
5hxk ZINC-DEPENDENT
PEPTIDASE

(Thermus
thermophilus) 		PF00675
(Peptidase_M16)
PF05193
(Peptidase_M16_C) 		5 PHE A  98
LEU A  11
VAL A  13
ALA A 349
ALA A 185
 PHE  A  98 ( 1.3A)
LEU  A  11 ( 0.5A)
VAL  A  13 ( 0.6A)
ALA  A 349 ( 0.0A)
ALA  A 185 ( 0.0A)
 1.28A 1q23A-5hxkA:
undetectable
1q23B-5hxkA:
undetectable		 1q23A-5hxkA:
18.01
1q23B-5hxkA:
18.01
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.
5ido 3' TERMINAL URIDYLYL
TRANSFERASE

(Trypanosoma
brucei) 		PF03828
(PAP_assoc) 		5 PHE A 313
SER A 475
PHE A 479
VAL A 300
ALA A 309
 None
None
UTP  A 701 (-4.5A)
None
None
 1.33A 1q23A-5idoA:
undetectable
1q23B-5idoA:
undetectable		 1q23A-5idoA:
17.58
1q23B-5idoA:
17.58
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.
5iwz SYNAPTONEMAL COMPLEX
PROTEIN 2

(Mus musculus) 		no annotation 5 PHE A 374
PHE A 308
VAL A 333
PHE A 388
ALA A 286
 None
 1.30A 1q23A-5iwzA:
undetectable
1q23B-5iwzA:
undetectable		 1q23A-5iwzA:
20.61
1q23B-5iwzA:
20.61
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.
5jmd HEPARINASE III
PROTEIN

(Bacteroides
thetaiotaomicron) 		PF07940
(Hepar_II_III)
PF16889
(Hepar_II_III_N) 		5 PHE A 295
SER A 404
ALA A 304
ALA A 305
HIS A 302
 None
 1.26A 1q23A-5jmdA:
undetectable
1q23B-5jmdA:
undetectable		 1q23A-5jmdA:
15.50
1q23B-5jmdA:
15.50
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.
5jsy PERIPLASMIC [NIFESE]
HYDROGENASE, SMALL
SUBUNIT

(Desulfovibrio
vulgaris) 		PF01058
(Oxidored_q6)
PF14720
(NiFe_hyd_SSU_C) 		5 PHE A 203
LEU A 193
VAL A 154
ALA A 122
ALA A 117
 None
 1.34A 1q23A-5jsyA:
undetectable
1q23B-5jsyA:
undetectable		 1q23A-5jsyA:
22.22
1q23B-5jsyA:
22.22
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.
5jtv UBIQUITIN
CARBOXYL-TERMINAL
HYDROLASE 7

(Homo sapiens) 		PF00443
(UCH)
PF14533
(USP7_C2) 		5 PHE A 283
PHE A 324
LEU A 238
VAL A 242
PHE A 264
 None
 1.26A 1q23A-5jtvA:
undetectable
1q23B-5jtvA:
undetectable		 1q23A-5jtvA:
16.90
1q23B-5jtvA:
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.
5lst ATP-DEPENDENT DNA
HELICASE Q4

(Homo sapiens) 		PF00270
(DEAD)
PF00271
(Helicase_C) 		5 PHE A 470
LEU A 514
VAL A 489
PHE A 481
ALA A 463
 None
 1.14A 1q23A-5lstA:
undetectable
1q23B-5lstA:
undetectable		 1q23A-5lstA:
14.57
1q23B-5lstA:
14.57
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.
5ode GLL2934 PROTEIN

(Gloeobacter
violaceus) 		no annotation 5 SER A 277
LEU A 259
VAL A  93
PHE A 100
ALA A 124
 None
 1.22A 1q23A-5odeA:
undetectable
1q23B-5odeA:
undetectable		 1q23A-5odeA:
21.19
1q23B-5odeA:
21.19
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.
5olt -

(-) 		no annotation 5 THR A 222
SER A 289
LEU A 285
VAL A 440
PHE A 271
 None
 1.32A 1q23A-5oltA:
undetectable
1q23B-5oltA:
undetectable		 1q23A-5oltA:
undetectable
1q23B-5oltA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5t88 PROLYL ENDOPEPTIDASE

(Pyrococcus
furiosus) 		PF00326
(Peptidase_S9)
PF02897
(Peptidase_S9_N) 		5 THR A 340
PHE A 319
SER A 341
PHE A 385
VAL A 298
 None
 1.26A 1q23A-5t88A:
undetectable
1q23B-5t88A:
undetectable		 1q23A-5t88A:
15.10
1q23B-5t88A:
15.10
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.
5tj3 ALKALINE PHOSPHATASE
PAFA

(Elizabethkingia
meningoseptica) 		PF01663
(Phosphodiest) 		5 THR A 439
LEU A 427
PHE A 372
ALA A 396
ALA A 397
 None
 1.16A 1q23A-5tj3A:
undetectable
1q23B-5tj3A:
undetectable		 1q23A-5tj3A:
15.91
1q23B-5tj3A:
15.91
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.
5ue0 CT622 PROTEIN

(Chlamydia
trachomatis) 		no annotation 5 PHE A 605
LEU A 482
PHE A 646
ALA A 537
ALA A 538
 None
 1.31A 1q23A-5ue0A:
undetectable
1q23B-5ue0A:
undetectable		 1q23A-5ue0A:
15.15
1q23B-5ue0A:
15.15
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.
5wb1 ENVELOPE PROTEIN
US28, NANOBODY 7
FUSION PROTEIN

(Human
betaherpesvirus
5;
Lama glama) 		no annotation 5 PHE A 197
PHE A 116
LEU A 119
PHE A 237
ALA A 280
 None
 1.16A 1q23A-5wb1A:
undetectable
1q23B-5wb1A:
undetectable		 1q23A-5wb1A:
17.59
1q23B-5wb1A:
17.59
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6bog RNA
POLYMERASE-ASSOCIATE
D PROTEIN RAPA

(Escherichia
coli) 		no annotation 5 SER A  11
PHE A  34
VAL A  30
PHE A   3
ALA A  44
 None
 1.23A 1q23A-6bogA:
undetectable
1q23B-6bogA:
undetectable		 1q23A-6bogA:
15.45
1q23B-6bogA:
15.45
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.
6cbo C-6'
AMINOTRANSFERASE

(Micromonospora
echinospora) 		no annotation 5 PHE A 258
LEU A 234
VAL A 230
ALA A 109
ALA A 110
 None
 1.33A 1q23A-6cboA:
undetectable
1q23B-6cboA:
undetectable		 1q23A-6cboA:
16.74
1q23B-6cboA:
16.74
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.
6cbo C-6'
AMINOTRANSFERASE

(Micromonospora
echinospora) 		no annotation 5 PHE A 301
PHE A  47
ALA A 333
ALA A 334
HIS A 331
 None
 1.34A 1q23A-6cboA:
undetectable
1q23B-6cboA:
undetectable		 1q23A-6cboA:
16.74
1q23B-6cboA:
16.74
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.
6cj7 SERPIN-12

(Manduca sexta) 		no annotation 5 PHE A 215
LEU A 222
PHE A 347
ALA A  25
ALA A 363
 None
 1.21A 1q23A-6cj7A:
undetectable
1q23B-6cj7A:
undetectable		 1q23A-6cj7A:
14.16
1q23B-6cj7A:
14.16
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.
6dd3 CYTOSOLIC PURINE
5'-NUCLEOTIDASE

(Homo sapiens) 		no annotation 5 VAL A  35
PHE A 369
ALA A 376
ALA A 463
HIS A  33
 None
 1.23A 1q23A-6dd3A:
undetectable
1q23B-6dd3A:
undetectable		 1q23A-6dd3A:
16.89
1q23B-6dd3A:
16.89