SIMILAR PATTERNS OF AMINO ACIDS FOR 4JTQ_A_FLPA401

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.
1f8w NADH PEROXIDASE

(Enterococcus
faecalis) 		PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2) 		5 VAL A  89
TYR A 104
VAL A  91
LEU A 255
LEU A 251
 None
 1.33A 4jtqA-1f8wA:
undetectable		 4jtqA-1f8wA:
21.76
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.
1gxl CHROMOSOME
SEGREGATION SMC
PROTEIN

(Thermotoga
maritima) 		PF06470
(SMC_hinge) 		5 VAL A 503
TYR A 496
VAL A 568
ILE A 570
LEU A 523
 None
 1.46A 4jtqA-1gxlA:
undetectable		 4jtqA-1gxlA:
20.30
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.
1jl5 OUTER PROTEIN YOPM

(Yersinia pestis) 		PF12468
(TTSSLRR) 		5 VAL A1138
VAL A1160
ILE A1158
LEU A1113
LEU A1133
 None
 1.48A 4jtqA-1jl5A:
undetectable		 4jtqA-1jl5A:
24.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1k82 FORMAMIDOPYRIMIDINE-
DNA GLYCOSYLASE

(Escherichia
coli) 		PF01149
(Fapy_DNA_glyco)
PF06827
(zf-FPG_IleRS)
PF06831
(H2TH) 		5 VAL A  92
TRP A 113
ILE A  40
LEU A  17
LEU A  60
 None
 1.28A 4jtqA-1k82A:
undetectable		 4jtqA-1k82A:
20.69
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1pto PERTUSSIS TOXIN

(Bordetella
pertussis) 		PF02918
(Pertussis_S2S3)
PF03440
(APT) 		5 VAL C 106
VAL C 130
ILE C 131
LEU C 153
LEU C 186
 None
 1.47A 4jtqA-1ptoC:
undetectable		 4jtqA-1ptoC:
21.47
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1q5m PROSTAGLANDIN-E2
9-REDUCTASE

(Oryctolagus
cuniculus) 		PF00248
(Aldo_ket_red) 		6 TYR A  24
TYR A  55
TRP A  86
HIS A 117
ILE A 129
TRP A 227
 None
NDP  A1003 (-4.9A)
None
NDP  A1003 (-4.3A)
None
None
 0.72A 4jtqA-1q5mA:
52.2		 4jtqA-1q5mA:
78.88
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.
1qrz PLASMINOGEN

(Homo sapiens) 		PF00089
(Trypsin) 		5 VAL A 777
VAL A 775
TRP A 783
LEU A 788
LEU A 649
 None
 1.45A 4jtqA-1qrzA:
undetectable		 4jtqA-1qrzA:
21.54
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.
1r62 NITROGEN REGULATION
PROTEIN NR(II)

(Escherichia
coli) 		PF02518
(HATPase_c) 		5 VAL A 343
TYR A 344
VAL A 241
ILE A 238
LEU A 228
 None
 1.40A 4jtqA-1r62A:
undetectable		 4jtqA-1r62A:
17.07
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.
1t33 PUTATIVE
TRANSCRIPTIONAL
REPRESSOR (TETR/ACRR
FAMILY)

(Salmonella
enterica) 		PF00440
(TetR_N)
PF09209
(DUF1956) 		5 VAL A 176
VAL A 207
ILE A 211
LEU A 144
LEU A 148
 None
 1.25A 4jtqA-1t33A:
undetectable		 4jtqA-1t33A:
23.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1tg5 4-HYDROXYPHENYLPYRUV
ATE DIOXYGENASE

(Arabidopsis
thaliana) 		PF00903
(Glyoxalase) 		5 VAL A 169
TYR A 171
HIS A  27
ILE A  99
LEU A  68
 None
 1.31A 4jtqA-1tg5A:
undetectable		 4jtqA-1tg5A:
22.79
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.
1u2x ADP-SPECIFIC
PHOSPHOFRUCTOKINASE

(Pyrococcus
horikoshii) 		PF04587
(ADP_PFK_GK) 		5 VAL A 281
VAL A 303
ILE A 269
LEU A 248
LEU A 262
 None
 1.13A 4jtqA-1u2xA:
undetectable		 4jtqA-1u2xA:
23.65
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.
1x9j PROBABLE BUTYRATE
KINASE 2

(Thermotoga
maritima) 		PF00871
(Acetate_kinase) 		5 TYR A 173
HIS A 192
VAL A 300
ILE A 299
LEU A 292
 None
 1.49A 4jtqA-1x9jA:
undetectable		 4jtqA-1x9jA:
23.44
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2ipf (3(17)ALPHA-HYDROXYS
TEROID
DEHYDROGENASE)

(Mus musculus) 		PF00248
(Aldo_ket_red) 		5 VAL A  54
TYR A  55
TRP A  86
HIS A 117
TRP A 227
 None
FFA  A   3 ( 4.5A)
None
FFA  A   3 ( 4.1A)
FFA  A   3 (-4.0A)
 0.80A 4jtqA-2ipfA:
51.5		 4jtqA-2ipfA:
72.45
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2ipj ALDO-KETO REDUCTASE
FAMILY 1 MEMBER C2

(Homo sapiens) 		PF00248
(Aldo_ket_red) 		9 VAL A  54
TYR A  55
TRP A  86
HIS A 117
VAL A 128
ILE A 129
TRP A 227
LEU A 306
LEU A 308
 FFA  A 325 (-4.8A)
FFA  A 325 ( 4.3A)
None
FFA  A 325 ( 3.8A)
None
None
FFA  A 325 (-3.8A)
FFA  A 325 (-4.8A)
FFA  A 325 (-4.5A)
 0.17A 4jtqA-2ipjA:
55.8		 4jtqA-2ipjA:
99.69
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2jf3 ACYL-[ACYL-CARRIER-P
ROTEIN]--UDP-N-ACETY
LGLUCOSAMINE
O-ACYLTRANSFERASE

(Escherichia
coli) 		PF00132
(Hexapep)
PF13720
(Acetyltransf_11) 		5 TYR A 223
VAL A 185
TYR A 219
VAL A 169
ILE A 165
 None
 1.36A 4jtqA-2jf3A:
undetectable		 4jtqA-2jf3A:
22.32
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.
2jhe TRANSCRIPTION
REGULATOR TYRR

(Escherichia
coli) 		PF13188
(PAS_8) 		5 VAL A   5
VAL A  64
ILE A  61
LEU A  28
LEU A  21
 None
 1.04A 4jtqA-2jheA:
undetectable		 4jtqA-2jheA:
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.
2nty RAC-LIKE GTP-BINDING
PROTEIN ARAC5

(Arabidopsis
thaliana) 		PF00071
(Ras) 		5 VAL C  80
VAL C 177
ILE C 174
LEU C  23
LEU C  58
 None
 1.39A 4jtqA-2ntyC:
2.2		 4jtqA-2ntyC:
19.02
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.
2nyk M157

(Murid
betaherpesvirus
1) 		PF11624
(M157) 		5 VAL A 123
TYR A 125
HIS A 116
VAL A 121
LEU A  86
 None
 1.46A 4jtqA-2nykA:
undetectable		 4jtqA-2nykA:
23.26
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.
2uyg 3-DEHYDROQUINATE
DEHYDRATASE

(Thermus
thermophilus) 		PF01220
(DHquinase_II) 		5 VAL A  98
VAL A  71
ILE A   4
LEU A  13
LEU A  10
 None
None
None
None
GOL  A1143 (-4.6A)
 1.41A 4jtqA-2uygA:
1.7		 4jtqA-2uygA:
19.76
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.
2vzw PROBABLE HISTIDINE
KINASE RESPONSE
REGULATOR

(Mycobacterium
tuberculosis) 		PF13185
(GAF_2) 		5 VAL A  97
VAL A  70
ILE A  69
LEU A 203
LEU A  62
 None
 1.23A 4jtqA-2vzwA:
undetectable		 4jtqA-2vzwA:
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.
2wym L-ASCORBATE-6-PHOSPH
ATE LACTONASE ULAG

(Escherichia
coli) 		PF13483
(Lactamase_B_3) 		5 VAL A 113
VAL A 131
ILE A 107
TRP A  49
LEU A  43
 None
None
GOL  A1343 (-3.9A)
GOL  A1343 ( 4.9A)
None
 1.26A 4jtqA-2wymA:
undetectable		 4jtqA-2wymA:
23.19
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.
3bv6 METAL-DEPENDENT
HYDROLASE

(Vibrio cholerae) 		PF13483
(Lactamase_B_3) 		5 VAL A 113
VAL A 131
ILE A 107
TRP A  49
LEU A  43
 None
 1.27A 4jtqA-3bv6A:
undetectable		 4jtqA-3bv6A:
20.90
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.
3f7q INTEGRIN BETA-4

(Homo sapiens) 		PF00041
(fn3) 		5 VAL A1273
VAL A1275
TRP A1240
LEU A1226
LEU A1238
 None
 1.40A 4jtqA-3f7qA:
undetectable		 4jtqA-3f7qA:
22.87
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.
3gbj KIF13B PROTEIN

(Homo sapiens) 		PF00225
(Kinesin) 		5 VAL A 146
VAL A 191
ILE A 197
LEU A  88
LEU A 126
 None
 1.40A 4jtqA-3gbjA:
undetectable		 4jtqA-3gbjA:
23.14
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.
3hj4 MINOR
EDITOSOME-ASSOCIATED
TUTASE

(Trypanosoma
brucei) 		no annotation 5 VAL A 244
TYR A 159
ILE A   9
LEU A 361
LEU A 365
 None
 1.31A 4jtqA-3hj4A:
undetectable		 4jtqA-3hj4A:
21.45
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.
3hww 2-SUCCINYL-5-ENOLPYR
UVYL-6-HYDROXY-3-CYC
LOHEXENE-1-CARBOXYLA
TE SYNTHASE

(Escherichia
coli) 		PF02775
(TPP_enzyme_C)
PF02776
(TPP_enzyme_N)
PF16582
(TPP_enzyme_M_2) 		5 VAL A 393
VAL A 467
ILE A 465
LEU A 403
LEU A 386
 None
None
None
NA  A 573 (-4.0A)
None
 1.02A 4jtqA-3hwwA:
undetectable		 4jtqA-3hwwA:
20.14
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.
3i2t EPIDERMAL GROWTH
FACTOR RECEPTOR,
ISOFORM A

(Drosophila
melanogaster) 		PF00757
(Furin-like)
PF01030
(Recep_L_domain)
PF14843
(GF_recep_IV) 		5 VAL A 429
TRP A 445
ILE A 448
LEU A 384
LEU A 416
 None
 1.22A 4jtqA-3i2tA:
undetectable		 4jtqA-3i2tA:
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.
3ihl CTP SYNTHASE 2

(Homo sapiens) 		PF06418
(CTP_synth_N) 		5 VAL A 144
VAL A   6
ILE A 178
LEU A 272
LEU A 270
 None
 1.28A 4jtqA-3ihlA:
2.3		 4jtqA-3ihlA:
23.32
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.
3l1c KINESIN-14 NCD

(Drosophila
melanogaster) 		PF00225
(Kinesin) 		5 VAL A 415
VAL A 453
ILE A 454
LEU A 561
LEU A 461
 None
 1.29A 4jtqA-3l1cA:
undetectable		 4jtqA-3l1cA:
20.39
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3ln3 DIHYDRODIOL
DEHYDROGENASE

(Mus musculus) 		PF00248
(Aldo_ket_red) 		5 TYR A  24
TYR A  55
TRP A  86
HIS A 117
LEU A 306
 MLY  A  25 (-3.6A)
NAD  A 327 ( 4.7A)
None
MRD  A 328 ( 3.9A)
MRD  A 328 ( 4.3A)
 0.70A 4jtqA-3ln3A:
50.5		 4jtqA-3ln3A:
66.25
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.
3no6 TRANSCRIPTIONAL
ACTIVATOR TENA

(Staphylococcus
epidermidis) 		PF03070
(TENA_THI-4) 		5 TYR A  40
VAL A 140
ILE A 144
TRP A 163
LEU A  32
 None
 1.50A 4jtqA-3no6A:
undetectable		 4jtqA-3no6A:
21.96
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.
3odh OKRAI ENDONUCLEASE

(Oceanobacter
kriegii) 		PF02923
(BamHI) 		5 TRP A 157
HIS A 109
VAL A 156
LEU A 131
LEU A 129
 None
 1.41A 4jtqA-3odhA:
undetectable		 4jtqA-3odhA:
22.96
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.
3qyb TBC1 DOMAIN FAMILY
MEMBER 4

(Homo sapiens) 		PF00566
(RabGAP-TBC) 		5 VAL A1116
VAL A1164
ILE A1161
LEU A 932
LEU A 916
 None
 1.46A 4jtqA-3qybA:
undetectable		 4jtqA-3qybA:
20.76
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.
3s3f TYROSINE-PROTEIN
PHOSPHATASE 10D

(Drosophila
melanogaster) 		PF00102
(Y_phosphatase) 		5 VAL A 285
VAL A 274
ILE A 273
LEU A 220
LEU A 255
 None
 1.47A 4jtqA-3s3fA:
undetectable		 4jtqA-3s3fA:
19.71
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.
3u2p RECEPTOR
TYROSINE-PROTEIN
KINASE ERBB-4

(Homo sapiens) 		PF00757
(Furin-like)
PF01030
(Recep_L_domain) 		5 VAL A 122
TRP A 138
ILE A 141
LEU A  72
LEU A 109
 None
 1.27A 4jtqA-3u2pA:
undetectable		 4jtqA-3u2pA:
20.08
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.
3u2p RECEPTOR
TYROSINE-PROTEIN
KINASE ERBB-4

(Homo sapiens) 		PF00757
(Furin-like)
PF01030
(Recep_L_domain) 		5 VAL A 122
TRP A 138
ILE A 141
LEU A  72
LEU A 111
 None
 1.42A 4jtqA-3u2pA:
undetectable		 4jtqA-3u2pA:
20.08
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.
3u7u RECEPTOR
TYROSINE-PROTEIN
KINASE ERBB-4

(Homo sapiens) 		PF00757
(Furin-like)
PF01030
(Recep_L_domain)
PF14843
(GF_recep_IV) 		5 VAL A 122
TRP A 138
ILE A 141
LEU A  72
LEU A 111
 None
 1.42A 4jtqA-3u7uA:
undetectable		 4jtqA-3u7uA:
18.57
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.
3wn6 ALPHA-AMYLASE

(Oryza sativa) 		PF00128
(Alpha-amylase)
PF07821
(Alpha-amyl_C2) 		5 TRP A 425
VAL A 415
ILE A 424
LEU A 386
LEU A 388
 None
 1.39A 4jtqA-3wn6A:
9.6		 4jtqA-3wn6A:
21.17
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.
3zhe NONSENSE-MEDIATED
MRNA DECAY PROTEIN

(Caenorhabditis
elegans) 		no annotation 5 TRP A 292
ILE A 293
TRP A 323
LEU A 315
LEU A 300
 None
 1.41A 4jtqA-3zheA:
undetectable		 4jtqA-3zheA:
22.17
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.
4dq8 ACETATE KINASE

(Mycobacterium
marinum) 		PF00871
(Acetate_kinase) 		5 VAL A  77
HIS A  79
VAL A 130
LEU A  20
LEU A  55
 None
 1.43A 4jtqA-4dq8A:
undetectable		 4jtqA-4dq8A:
21.31
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.
4h32 HEMAGGLUTININ

(Influenza A
virus) 		PF00509
(Hemagglutinin) 		5 TYR A 257
VAL A 112
ILE A  83
LEU A 176
LEU A  65
 None
 1.48A 4jtqA-4h32A:
undetectable		 4jtqA-4h32A:
22.25
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.
4h32 HEMAGGLUTININ

(Influenza A
virus) 		PF00509
(Hemagglutinin) 		5 VAL A 112
TRP A  80
ILE A  83
LEU A 176
LEU A  65
 None
 1.22A 4jtqA-4h32A:
undetectable		 4jtqA-4h32A:
22.25
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4hbk ALDO-KETO REDUCTASE
FAMILY 1, MEMBER B4
(ALDOSE REDUCTASE)

(Schistosoma
japonicum) 		PF00248
(Aldo_ket_red) 		5 VAL A  47
TYR A  48
TRP A  79
HIS A 110
LEU A 295
 None
 0.85A 4jtqA-4hbkA:
43.7		 4jtqA-4hbkA:
40.85
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.
4hln STARCH SYNTHASE I

(Hordeum vulgare) 		PF00534
(Glycos_transf_1)
PF08323
(Glyco_transf_5) 		5 VAL A 192
VAL A 177
ILE A 166
LEU A 234
LEU A 232
 None
 1.50A 4jtqA-4hlnA:
undetectable		 4jtqA-4hlnA:
20.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4j0m SERINE/THREONINE-PRO
TEIN KINASE
BRI1-LIKE 1

(Arabidopsis
thaliana) 		PF08263
(LRRNT_2)
PF13516
(LRR_6)
PF13855
(LRR_8) 		5 VAL A 146
TYR A 145
VAL A 156
ILE A 158
LEU A  93
 None
 1.47A 4jtqA-4j0mA:
undetectable		 4jtqA-4j0mA:
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.
4k30 N-ACETYLGLUTAMATE
SYNTHASE,
MITOCHONDRIAL

(Homo sapiens) 		PF04768
(NAT) 		5 TYR A 407
VAL A 395
VAL A 446
LEU A 383
LEU A 386
 None
 1.27A 4jtqA-4k30A:
undetectable		 4jtqA-4k30A:
20.41
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.
4u02 AMINO ACID ABC
TRANSPORTER,
ATP-BINDING PROTEIN

(Thermus
thermophilus) 		PF00005
(ABC_tran) 		5 VAL A  68
VAL A  63
ILE A   5
LEU A  20
LEU A  10
 None
 1.37A 4jtqA-4u02A:
undetectable		 4jtqA-4u02A:
21.47
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.
4w5k ASPARTATE
AMINOTRANSFERASE,
MITOCHONDRIAL

(Trypanosoma
brucei) 		PF00155
(Aminotran_1_2) 		5 TRP A 329
VAL A 317
ILE A 332
LEU A 352
LEU A 344
 EDO  A 502 (-4.0A)
None
None
None
None
 1.38A 4jtqA-4w5kA:
undetectable		 4jtqA-4w5kA:
23.61
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.
4x6d T-CELL SURFACE
GLYCOPROTEIN CD1A

(Homo sapiens) 		PF07654
(C1-set)
PF16497
(MHC_I_3) 		5 TRP A  14
VAL A  28
ILE A  13
LEU A 162
LEU A 114
 OLA  A 304 ( 4.3A)
None
None
None
None
 1.29A 4jtqA-4x6dA:
undetectable		 4jtqA-4x6dA:
20.95
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.
4zvi DNA GYRASE SUBUNIT B

(Escherichia
coli) 		PF00204
(DNA_gyraseB)
PF02518
(HATPase_c) 		5 TYR A 360
HIS A 237
VAL A 372
ILE A 375
LEU A 319
 None
 1.15A 4jtqA-4zviA:
undetectable		 4jtqA-4zviA:
23.65
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.
5aa6 VANADIUM-DEPENDENT
BROMOPEROXIDASE 2

(Ascophyllum
nodosum) 		no annotation 5 VAL A 393
VAL A 407
ILE A 406
LEU A 381
LEU A 167
 None
 1.46A 4jtqA-5aa6A:
undetectable		 4jtqA-5aa6A:
21.93
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.
5eik UNCHARACTERIZED
PROTEIN Y57A10A.28

(Caenorhabditis
elegans) 		PF05197
(TRIC) 		5 VAL A  22
TYR A  21
VAL A 226
ILE A 230
LEU A 129
 None
DMU  A 310 ( 2.9A)
None
None
None
 1.49A 4jtqA-5eikA:
undetectable		 4jtqA-5eikA:
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.
5fb3 GLYCEROL-1-PHOSPHATE
DEHYDROGENASE
[NAD(P)+]

(Pyrobaculum
calidifontis) 		PF13685
(Fe-ADH_2) 		5 VAL A 335
TYR A 269
ILE A 338
LEU A 323
LEU A 305
 None
 1.50A 4jtqA-5fb3A:
undetectable		 4jtqA-5fb3A:
22.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5hzh RAS-RELATED C3
BOTULINUM TOXIN
SUBSTRATE
1,NPH1-1,RAS-RELATED
C3 BOTULINUM TOXIN
SUBSTRATE 1

(Avena sativa;
Homo sapiens) 		PF00071
(Ras)
PF13426
(PAS_9) 		5 VAL A 226
VAL A 325
ILE A 322
LEU A  20
LEU A 204
 None
 1.48A 4jtqA-5hzhA:
undetectable		 4jtqA-5hzhA:
24.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5kdx METALLOPEPTIDASE

(Pseudomonas
aeruginosa) 		PF13402
(Peptidase_M60) 		5 VAL A 249
TYR A 139
VAL A 185
LEU A 165
LEU A 220
 None
 1.34A 4jtqA-5kdxA:
undetectable		 4jtqA-5kdxA:
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.
5ktk POLYKETIDE SYNTHASE
PKSJ

(Bacillus
subtilis) 		PF08659
(KR) 		5 VAL A 248
VAL A 220
ILE A 315
LEU A 295
LEU A 354
 None
None
None
NDP  A 601 ( 4.8A)
None
 1.44A 4jtqA-5ktkA:
undetectable		 4jtqA-5ktkA:
22.86
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.
5mh5 D-2-HYDROXYACID
DEHYDROGENASE

(Haloferax
mediterranei) 		no annotation 5 TRP A  61
HIS A  63
ILE A 297
LEU A  25
LEU A   6
 None
 1.34A 4jtqA-5mh5A:
undetectable		 4jtqA-5mh5A:
14.92
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.
5u03 CTP SYNTHASE 1

(Homo sapiens) 		PF00117
(GATase)
PF06418
(CTP_synth_N) 		5 VAL A 144
VAL A   6
ILE A 178
LEU A 272
LEU A 270
 None
 1.21A 4jtqA-5u03A:
undetectable		 4jtqA-5u03A:
19.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5wqn PROBABLE
DEHYDROGENASE

(Pseudomonas
aeruginosa) 		PF00106
(adh_short) 		5 VAL A 130
VAL A 124
ILE A  77
LEU A  59
LEU A 116
 None
 1.50A 4jtqA-5wqnA:
undetectable		 4jtqA-5wqnA:
21.99
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.
5zc3 -

(-) 		no annotation 5 VAL B 121
TRP B 117
VAL B  92
LEU B 166
LEU B 137
 None
 1.33A 4jtqA-5zc3B:
undetectable		 4jtqA-5zc3B:
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.
6d6q EXOSOME COMPLEX
EXONUCLEASE RRP44

(Homo sapiens) 		no annotation 5 VAL K 873
VAL K 862
ILE K 852
LEU K 885
LEU K 894
 None
 1.43A 4jtqA-6d6qK:
undetectable		 4jtqA-6d6qK:
13.76