SIMILAR PATTERNS OF AMINO ACIDS FOR 4YIA_B_IMNB401_2

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.
1drk D-RIBOSE-BINDING
PROTEIN

(Escherichia
coli) 		PF13407
(Peripla_BP_4) 		3 LEU A 198
ARG A 166
ARG A 199
 None
 0.94A 4yiaB-1drkA:
0.0		 4yiaB-1drkA:
8.12
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1fpr PROTEIN-TYROSINE
PHOSPHATASE 1C

(Homo sapiens) 		PF00102
(Y_phosphatase) 		3 LEU A 265
ARG A 288
ARG A 269
 None
 0.96A 4yiaB-1fprA:
0.0		 4yiaB-1fprA:
9.35
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.
1fvi CHLORELLA VIRUS DNA
LIGASE-ADENYLATE

(Chlorella virus) 		PF01068
(DNA_ligase_A_M)
PF14743
(DNA_ligase_OB_2) 		3 LEU A 149
ARG A 153
ARG A 285
 None
 0.90A 4yiaB-1fviA:
0.0		 4yiaB-1fviA:
7.80
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.
1gp1 GLUTATHIONE
PEROXIDASE

(Bos taurus) 		PF00255
(GSHPx) 		3 LEU A  67
ARG A  65
ARG A  61
 None
 0.97A 4yiaB-1gp1A:
0.0		 4yiaB-1gp1A:
9.60
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.
1jvw MACROPHAGE
INFECTIVITY
POTENTIATOR

(Trypanosoma
cruzi) 		PF00254
(FKBP_C) 		3 LEU A 129
ARG A  72
ARG A 131
 None
 0.90A 4yiaB-1jvwA:
0.0		 4yiaB-1jvwA:
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.
1los OROTIDINE
MONOPHOSPHATE
DECARBOXYLASE

(Methanothermobacter
thermautotrophicus) 		PF00215
(OMPdecase) 		3 LEU A 167
ARG A 166
ARG A 163
 None
 0.88A 4yiaB-1losA:
undetectable		 4yiaB-1losA:
22.89
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.
1ojl TRANSCRIPTIONAL
REGULATORY PROTEIN
ZRAR

(Salmonella
enterica) 		PF00158
(Sigma54_activat)
PF02954
(HTH_8) 		3 LEU A 312
ARG A 313
ARG A 316
 None
 0.87A 4yiaB-1ojlA:
undetectable		 4yiaB-1ojlA:
9.47
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.
1t46 HOMO SAPIENS V-KIT
HARDY-ZUCKERMAN 4
FELINE SARCOMA VIRAL
ONCOGENE HOMOLOG

(Homo sapiens) 		PF07714
(Pkinase_Tyr) 		3 LEU A 682
ARG A 683
ARG A 686
 None
 0.92A 4yiaB-1t46A:
0.0		 4yiaB-1t46A:
7.57
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.
1u08 HYPOTHETICAL
AMINOTRANSFERASE
YBDL

(Escherichia
coli) 		PF00155
(Aminotran_1_2) 		3 LEU A 275
ARG A  51
ARG A 282
 None
 0.94A 4yiaB-1u08A:
0.0		 4yiaB-1u08A:
7.69
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.
1wxj TRYPTOPHAN SYNTHASE
ALPHA CHAIN

(Thermus
thermophilus) 		PF00290
(Trp_syntA) 		3 LEU A 253
ARG A  15
ARG A 255
 None
 0.88A 4yiaB-1wxjA:
undetectable		 4yiaB-1wxjA:
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.
1zel HYPOTHETICAL PROTEIN
RV2827C

(Mycobacterium
tuberculosis) 		PF09407
(AbiEi_1)
PF13338
(AbiEi_4) 		3 LEU A 219
ARG A 218
ARG A 215
 None
None
FMT  A 712 (-4.8A)
 0.95A 4yiaB-1zelA:
undetectable		 4yiaB-1zelA:
8.05
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.
2ajr SUGAR KINASE, PFKB
FAMILY

(Thermotoga
maritima) 		PF00294
(PfkB) 		3 LEU A 175
ARG A 178
ARG A 174
 None
 0.84A 4yiaB-2ajrA:
0.0		 4yiaB-2ajrA:
8.36
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.
2bxy MALTOOLIGOSYLTREHALO
SE TREHALOHYDROLASE

(Deinococcus
radiodurans) 		PF00128
(Alpha-amylase)
PF02922
(CBM_48)
PF11941
(DUF3459) 		3 LEU A 513
ARG A 512
ARG A 509
 None
 0.97A 4yiaB-2bxyA:
undetectable		 4yiaB-2bxyA:
5.01
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.
2dwc 433AA LONG
HYPOTHETICAL
PHOSPHORIBOSYLGLYCIN
AMIDE FORMYL
TRANSFERASE

(Pyrococcus
horikoshii) 		PF02222
(ATP-grasp) 		3 LEU A 124
ARG A 121
ARG A 125
 None
ADP  A 501 (-2.6A)
None
 0.90A 4yiaB-2dwcA:
undetectable		 4yiaB-2dwcA:
6.54
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2eyq TRANSCRIPTION-REPAIR
COUPLING FACTOR

(Escherichia
coli) 		PF00270
(DEAD)
PF00271
(Helicase_C)
PF02559
(CarD_CdnL_TRCF)
PF03461
(TRCF) 		3 LEU A 803
ARG A 804
ARG A 302
 None
 0.81A 4yiaB-2eyqA:
undetectable		 4yiaB-2eyqA:
2.78
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.
2f8a GLUTATHIONE
PEROXIDASE 1

(Homo sapiens) 		PF00255
(GSHPx) 		3 LEU A  69
ARG A  67
ARG A  63
 None
 0.92A 4yiaB-2f8aA:
undetectable		 4yiaB-2f8aA:
8.54
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.
2fbl HYPOTHETICAL PROTEIN
NE1496

(Nitrosomonas
europaea) 		PF01928
(CYTH) 		3 LEU A  39
ARG A  81
ARG A  24
 None
 0.94A 4yiaB-2fblA:
undetectable		 4yiaB-2fblA:
12.24
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.
2fiq PUTATIVE TAGATOSE
6-PHOSPHATE KINASE 1

(Escherichia
coli) 		PF08013
(Tagatose_6_P_K) 		3 LEU A 411
ARG A 412
ARG A 415
 None
 0.97A 4yiaB-2fiqA:
undetectable		 4yiaB-2fiqA:
8.61
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.
2ge3 PROBABLE
ACETYLTRANSFERASE

(Agrobacterium
tumefaciens) 		PF00583
(Acetyltransf_1) 		3 LEU A 106
ARG A 109
ARG A 105
 None
 0.93A 4yiaB-2ge3A:
undetectable		 4yiaB-2ge3A:
11.49
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.
2h0a TRANSCRIPTIONAL
REGULATOR

(Thermus
thermophilus) 		PF13377
(Peripla_BP_3) 		3 LEU A 139
ARG A 138
ARG A 154
 None
 0.97A 4yiaB-2h0aA:
undetectable		 4yiaB-2h0aA:
7.66
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2nox TRYPTOPHAN
2,3-DIOXYGENASE

(Cupriavidus
metallidurans) 		PF03301
(Trp_dioxygenase) 		3 LEU A  86
ARG A  87
ARG A  90
 None
 0.88A 4yiaB-2noxA:
undetectable		 4yiaB-2noxA:
12.04
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.
2osy ENDOGLYCOCERAMIDASE
II

(Rhodococcus sp.) 		PF00150
(Cellulase) 		3 LEU A  54
ARG A 411
ARG A  52
 None
 0.86A 4yiaB-2osyA:
undetectable		 4yiaB-2osyA:
4.82
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.
2put ISOMERASE DOMAIN OF
GLUTAMINE-FRUCTOSE-6
-PHOSPHATE
TRANSAMINASE
(ISOMERIZING)

(Candida
albicans) 		PF01380
(SIS) 		3 LEU A 434
ARG A 437
ARG A 468
 None
 0.63A 4yiaB-2putA:
undetectable		 4yiaB-2putA:
7.20
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.
3bpv TRANSCRIPTIONAL
REGULATOR

(Methanothermobacter
thermautotrophicus) 		PF01047
(MarR) 		3 LEU A  15
ARG A  16
ARG A  19
 None
 0.95A 4yiaB-3bpvA:
undetectable		 4yiaB-3bpvA:
14.93
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.
3bqw PUTATIVE CAPSID
PROTEIN OF PROPHAGE

(Escherichia
coli) 		PF03864
(Phage_cap_E) 		3 LEU A 120
ARG A 119
ARG A 116
 None
 0.85A 4yiaB-3bqwA:
undetectable		 4yiaB-3bqwA:
8.05
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.
3cjn TRANSCRIPTIONAL
REGULATOR, MARR
FAMILY

(Ruegeria
pomeroyi) 		PF01047
(MarR) 		3 LEU A  38
ARG A  39
ARG A  53
 None
 0.81A 4yiaB-3cjnA:
undetectable		 4yiaB-3cjnA:
11.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3clo TRANSCRIPTIONAL
REGULATOR

(Bacteroides
thetaiotaomicron) 		PF00196
(GerE) 		3 LEU A 205
ARG A 206
ARG A 209
 None
 0.95A 4yiaB-3cloA:
undetectable		 4yiaB-3cloA:
9.01
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.
3ebl GIBBERELLIN RECEPTOR
GID1

(Oryza sativa) 		PF07859
(Abhydrolase_3) 		3 LEU A 248
ARG A 265
ARG A 301
 None
NO3  A 602 (-3.3A)
None
 0.96A 4yiaB-3eblA:
undetectable		 4yiaB-3eblA:
7.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3eus DNA-BINDING PROTEIN

(Ruegeria
pomeroyi) 		PF01381
(HTH_3) 		3 LEU A  52
ARG A  51
ARG A  50
 None
 0.81A 4yiaB-3eusA:
undetectable		 4yiaB-3eusA:
22.09
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.
3gzb PUTATIVE SNOAL-LIKE
POLYKETIDE CYCLASE

(Shewanella
putrefaciens) 		PF12680
(SnoaL_2) 		3 LEU A 130
ARG A 133
ARG A 132
 None
 0.84A 4yiaB-3gzbA:
undetectable		 4yiaB-3gzbA:
12.50
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.
3hdy UDP-GALACTOPYRANOSE
MUTASE

(Deinococcus
radiodurans) 		PF03275
(GLF)
PF13450
(NAD_binding_8) 		3 LEU A 277
ARG A 328
ARG A 275
 None
 0.97A 4yiaB-3hdyA:
undetectable		 4yiaB-3hdyA:
5.13
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.
3hlk ACYL-COENZYME A
THIOESTERASE 2,
MITOCHONDRIAL

(Homo sapiens) 		PF04775
(Bile_Hydr_Trans)
PF08840
(BAAT_C) 		3 LEU A 155
ARG A 154
ARG A 158
 None
 0.96A 4yiaB-3hlkA:
undetectable		 4yiaB-3hlkA:
7.32
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.
3i2v ADENYLYLTRANSFERASE
AND
SULFURTRANSFERASE
MOCS3

(Homo sapiens) 		PF00581
(Rhodanese) 		3 LEU A  33
ARG A  32
ARG A  23
 None
 0.86A 4yiaB-3i2vA:
undetectable		 4yiaB-3i2vA:
13.91
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.
3jsa HOMOSERINE
DEHYDROGENASE

(Thermoplasma
volcanium) 		PF00742
(Homoserine_dh)
PF03447
(NAD_binding_3) 		3 LEU A  19
ARG A  20
ARG A  23
 None
 0.87A 4yiaB-3jsaA:
undetectable		 4yiaB-3jsaA:
7.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3k70 EXODEOXYRIBONUCLEASE
V ALPHA CHAIN

(Escherichia
coli) 		PF13538
(UvrD_C_2)
PF13604
(AAA_30) 		3 LEU D 244
ARG D 242
ARG D 200
 None
 0.96A 4yiaB-3k70D:
undetectable		 4yiaB-3k70D:
4.21
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.
3ksc LEGA CLASS

(Pisum sativum) 		PF00190
(Cupin_1) 		3 LEU A 199
ARG A 207
ARG A 216
 None
None
SO4  A 498 ( 4.8A)
 0.93A 4yiaB-3kscA:
undetectable		 4yiaB-3kscA:
5.44
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.
3p8c ABL INTERACTOR 2

(Homo sapiens) 		PF07815
(Abi_HHR) 		3 LEU F  83
ARG F  85
ARG F  84
 None
 0.94A 4yiaB-3p8cF:
undetectable		 4yiaB-3p8cF:
10.69
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.
3pgx CARVEOL
DEHYDROGENASE

(Mycobacterium
avium) 		PF13561
(adh_short_C2) 		3 LEU A  88
ARG A  89
ARG A 141
 None
 0.94A 4yiaB-3pgxA:
undetectable		 4yiaB-3pgxA:
12.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3skd PUTATIVE
UNCHARACTERIZED
PROTEIN TTHB187

(Thermus
thermophilus) 		no annotation 3 LEU A 111
ARG A 165
ARG A 115
 None
 0.87A 4yiaB-3skdA:
undetectable		 4yiaB-3skdA:
8.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3swg UDP-N-ACETYLGLUCOSAM
INE
1-CARBOXYVINYLTRANSF
ERASE

(Aquifex
aeolicus) 		PF00275
(EPSP_synthase) 		3 LEU A 120
ARG A  97
ARG A 100
 None
None
QPA  A 124 ( 4.0A)
 0.72A 4yiaB-3swgA:
undetectable		 4yiaB-3swgA:
5.41
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.
3tma METHYLTRANSFERASE

(Thermus
thermophilus) 		PF01170
(UPF0020)
PF02926
(THUMP) 		3 LEU A  75
ARG A  77
ARG A 113
 None
None
PO4  A 401 ( 4.5A)
 0.86A 4yiaB-3tmaA:
undetectable		 4yiaB-3tmaA:
10.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4d8m PESTICIDAL CRYSTAL
PROTEIN CRY5BA

(Bacillus
thuringiensis) 		PF03944
(Endotoxin_C)
PF03945
(Endotoxin_N) 		3 LEU A 317
ARG A 341
ARG A 582
 None
 0.86A 4yiaB-4d8mA:
undetectable		 4yiaB-4d8mA:
5.36
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.
4dpy MEVALONATE
DIPHOSPHATE
DECARBOXYLASE

(Staphylococcus
epidermidis) 		PF00288
(GHMP_kinases_N) 		3 LEU A 134
ARG A 137
ARG A 133
 None
 0.87A 4yiaB-4dpyA:
undetectable		 4yiaB-4dpyA:
10.90
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.
4dyo ASPARTYL
AMINOPEPTIDASE

(Homo sapiens) 		PF02127
(Peptidase_M18) 		3 LEU A 240
ARG A 101
ARG A 104
 None
 0.88A 4yiaB-4dyoA:
undetectable		 4yiaB-4dyoA:
5.25
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.
4en8 HEMAGGLUTININ
COMPONENTS
HA-22/23/53

(Clostridium
botulinum) 		PF03505
(Clenterotox) 		3 LEU B 587
ARG B 555
ARG B 557
 None
 0.93A 4yiaB-4en8B:
undetectable		 4yiaB-4en8B:
10.04
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4gkg C4-DICARBOXYLATE
TRANSPORT SENSOR
PROTEIN DCTB

(Sinorhizobium
meliloti) 		no annotation 3 LEU A 369
ARG A 370
ARG A 373
 None
 0.96A 4yiaB-4gkgA:
undetectable		 4yiaB-4gkgA:
31.11
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.
4hh2 TRANSCRIPTIONAL
REGULATOR, PPSR

(Rhodobacter
sphaeroides) 		PF13188
(PAS_8)
PF13426
(PAS_9) 		3 LEU A 155
ARG A 152
ARG A 187
 None
 0.92A 4yiaB-4hh2A:
undetectable		 4yiaB-4hh2A:
9.88
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.
4i8o TOXIN RNLA

(Escherichia
coli) 		PF15935
(RnlA_toxin) 		3 LEU A 169
ARG A 173
ARG A 194
 None
 0.96A 4yiaB-4i8oA:
undetectable		 4yiaB-4i8oA:
8.81
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.
4i93 PROBABLE
SERINE/THREONINE-PRO
TEIN KINASE
AT5G41260

(Arabidopsis
thaliana) 		PF07714
(Pkinase_Tyr) 		3 LEU A 162
ARG A 159
ARG A 114
 None
 0.82A 4yiaB-4i93A:
undetectable		 4yiaB-4i93A:
10.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4imp POLYKETIDE SYNTHASE
EXTENDER MODULES 3-4

(Saccharopolyspora
spinosa) 		PF08659
(KR) 		3 LEU A 468
ARG A 470
ARG A 469
 None
 0.91A 4yiaB-4impA:
undetectable		 4yiaB-4impA:
6.52
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.
4iws PA0254

(Pseudomonas
aeruginosa) 		PF01977
(UbiD) 		3 LEU A  15
ARG A  17
ARG A  16
 None
 0.96A 4yiaB-4iwsA:
undetectable		 4yiaB-4iwsA:
5.61
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.
4j2k TRYPSIN INHIBITOR

(Enterolobium
contortisiliquum) 		PF00197
(Kunitz_legume) 		3 LEU A  23
ARG A  24
ARG A 168
 None
None
GOL  A 202 (-3.7A)
 0.81A 4yiaB-4j2kA:
undetectable		 4yiaB-4j2kA:
11.05
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.
4k3e BOVINE ANTIBODY WITH
ULTRALONG CDR H3,
HEAVY CHAIN

(Bos taurus) 		PF07654
(C1-set)
PF07686
(V-set) 		3 LEU H 107
ARG H 105
ARG H   5
 None
 0.95A 4yiaB-4k3eH:
undetectable		 4yiaB-4k3eH:
6.77
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.
4kp9 PAPAIN

(Carica papaya) 		PF00112
(Peptidase_C1) 		3 LEU A  74
ARG A  59
ARG A  58
 None
 0.83A 4yiaB-4kp9A:
undetectable		 4yiaB-4kp9A:
10.38
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.
4kvo N-TERMINAL
ACETYLTRANSFERASE A
COMPLEX SUBUNIT NAT1

(Schizosaccharomyces
pombe) 		PF12569
(NARP1) 		3 LEU A 247
ARG A 228
ARG A 221
 SO4  A 812 (-4.2A)
None
SO4  A 812 (-3.5A)
 0.83A 4yiaB-4kvoA:
undetectable		 4yiaB-4kvoA:
4.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4lfy DIHYDROOROTASE

(Burkholderia
cenocepacia) 		PF01979
(Amidohydro_1) 		3 LEU A 211
ARG A 262
ARG A 180
 None
 0.67A 4yiaB-4lfyA:
undetectable		 4yiaB-4lfyA:
8.22
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.
4n78 ABL INTERACTOR 2

(Homo sapiens) 		PF07815
(Abi_HHR) 		3 LEU F  83
ARG F  85
ARG F  84
 None
 0.95A 4yiaB-4n78F:
undetectable		 4yiaB-4n78F:
5.32
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.
4nh0 CELL
DIVISIONFTSK/SPOIIIE

(Thermomonospora
curvata) 		PF01580
(FtsK_SpoIIIE) 		3 LEU A 436
ARG A 440
ARG A 438
 None
 0.93A 4yiaB-4nh0A:
undetectable		 4yiaB-4nh0A:
2.96
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.
4paf TRAP DICARBOXYLATE
TRANSPORTER, DCTP
SUBUNIT, PUTATIVE

(Ruegeria
pomeroyi) 		PF03480
(DctP) 		3 LEU A 121
ARG A 122
ARG A 127
 None
 0.95A 4yiaB-4pafA:
undetectable		 4yiaB-4pafA:
7.10
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.
4pts GLUTATHIONE
S-TRANSFERASE

(Gordonia
bronchialis) 		PF13409
(GST_N_2)
PF13410
(GST_C_2) 		3 LEU A  68
ARG A 156
ARG A  67
 None
 0.88A 4yiaB-4ptsA:
undetectable		 4yiaB-4ptsA:
6.41
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.
4pxb UREIDOGLYCOLATE
HYDROLASE

(Arabidopsis
thaliana) 		PF01546
(Peptidase_M20) 		3 LEU A 427
ARG A 196
ARG A 431
 None
 0.81A 4yiaB-4pxbA:
undetectable		 4yiaB-4pxbA:
7.73
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.
4rg8 EXONUCLEASE I

(Methylocaldum
szegediense) 		PF00929
(RNase_T)
PF08411
(Exonuc_X-T_C) 		3 LEU A 137
ARG A 138
ARG A 141
 None
 0.86A 4yiaB-4rg8A:
undetectable		 4yiaB-4rg8A:
5.84
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.
4rrj PROBABLE
THREONINE--TRNA
LIGASE 2

(Aeropyrum
pernix) 		PF08915
(tRNA-Thr_ED) 		3 LEU A   4
ARG A 132
ARG A   2
 None
 0.97A 4yiaB-4rrjA:
undetectable		 4yiaB-4rrjA:
11.76
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4s2t PROTEIN APP-1

(Caenorhabditis
elegans) 		PF00557
(Peptidase_M24)
PF01321
(Creatinase_N)
PF16188
(Peptidase_M24_C)
PF16189
(Creatinase_N_2) 		3 LEU P 331
ARG P 332
ARG P 600
 None
 0.78A 4yiaB-4s2tP:
undetectable		 4yiaB-4s2tP:
4.86
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.
4xq7 2'-5'-OLIGOADENYLATE
SYNTHASE-LIKE
PROTEIN

(Homo sapiens) 		PF10421
(OAS1_C) 		3 LEU A  62
ARG A  45
ARG A  60
 None
 0.97A 4yiaB-4xq7A:
undetectable		 4yiaB-4xq7A:
6.81
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.
5anb ELONGATION FACTOR TU
GTP-BINDING
DOMAIN-CONTAINING
PROTEIN 1

(Homo sapiens) 		PF00009
(GTP_EFTU)
PF00679
(EFG_C)
PF14492
(EFG_II) 		3 LEU K 878
ARG K 970
ARG K1095
 None
 0.85A 4yiaB-5anbK:
undetectable		 4yiaB-5anbK:
2.94
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.
5bp8 ENT-COPALYL
DIPHOSPHATE SYNTHASE

(Streptomyces
platensis) 		PF00432
(Prenyltrans)
PF13243
(SQHop_cyclase_C) 		3 LEU A 517
ARG A 516
ARG A 513
 None
SO4  A 702 (-3.1A)
None
 0.91A 4yiaB-5bp8A:
undetectable		 4yiaB-5bp8A:
4.59
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.
5d2j 4-OXALOCROTONATE
DECARBOXYLASE NAHK

(Pseudomonas
putida) 		no annotation 3 LEU A  11
ARG A  52
ARG A  51
 None
 0.91A 4yiaB-5d2jA:
undetectable		 4yiaB-5d2jA:
10.65
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.
5dhm IMMUNOREACTIVE 32
KDA ANTIGEN

(Porphyromonas
gingivalis) 		no annotation 3 LEU C 312
ARG C 314
ARG C 211
 None
 0.75A 4yiaB-5dhmC:
undetectable		 4yiaB-5dhmC:
6.74
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.
5dm3 L-GLUTAMINE
SYNTHETASE

(Chromohalobacter
salexigens) 		PF00120
(Gln-synt_C) 		3 LEU A 408
ARG A 409
ARG A 415
 None
 0.46A 4yiaB-5dm3A:
undetectable		 4yiaB-5dm3A:
5.37
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.
5dq6 TUMOR NECROSIS
FACTOR ALPHA-INDUCED
PROTEIN 3

(Mus musculus) 		PF02338
(OTU) 		3 LEU A 270
ARG A 271
ARG A  90
 None
 0.76A 4yiaB-5dq6A:
undetectable		 4yiaB-5dq6A:
7.51
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.
5ee0 OBG-LIKE ATPASE 1

(Oryza sativa) 		PF01926
(MMR_HSR1)
PF06071
(YchF-GTPase_C) 		3 LEU A 154
ARG A 155
ARG A 202
 None
 0.88A 4yiaB-5ee0A:
undetectable		 4yiaB-5ee0A:
8.60
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.
5ehk LANTIBIOTIC
DEHYDRATASE

(Microbispora
corallina) 		PF04738
(Lant_dehydr_N)
PF14028
(Lant_dehydr_C) 		3 LEU A1086
ARG A1093
ARG A 859
 None
 0.94A 4yiaB-5ehkA:
undetectable		 4yiaB-5ehkA:
3.91
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.
5gpy GENERAL
TRANSCRIPTION FACTOR
IIE SUBUNIT 1

(Homo sapiens) 		PF02002
(TFIIE_alpha)
PF08271
(TF_Zn_Ribbon) 		3 LEU A  59
ARG A  56
ARG A  60
 None
 0.81A 4yiaB-5gpyA:
undetectable		 4yiaB-5gpyA:
9.81
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.
5iay E3 UBIQUITIN-PROTEIN
LIGASE UHRF1

(Homo sapiens) 		PF12148
(TTD) 		3 LEU A 178
ARG A 161
ARG A 175
 None
 0.74A 4yiaB-5iayA:
undetectable		 4yiaB-5iayA:
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.
5ip9 DNA-DIRECTED RNA
POLYMERASE II
SUBUNIT RPB2

(Saccharomyces
cerevisiae) 		PF00562
(RNA_pol_Rpb2_6)
PF04560
(RNA_pol_Rpb2_7)
PF04561
(RNA_pol_Rpb2_2)
PF04563
(RNA_pol_Rpb2_1)
PF04565
(RNA_pol_Rpb2_3)
PF04566
(RNA_pol_Rpb2_4)
PF04567
(RNA_pol_Rpb2_5) 		3 LEU B 600
ARG B 601
ARG B 604
 None
 0.76A 4yiaB-5ip9B:
undetectable		 4yiaB-5ip9B:
2.69
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.
5j68 ASTROTACTIN-2

(Homo sapiens) 		PF01823
(MACPF) 		3 LEU A1214
ARG A1218
ARG A1217
 None
 0.94A 4yiaB-5j68A:
undetectable		 4yiaB-5j68A:
5.08
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.
5lj3 PRP46

(Saccharomyces
cerevisiae) 		PF00400
(WD40) 		3 LEU J 403
ARG J 186
ARG J 312
 None
 0.82A 4yiaB-5lj3J:
undetectable		 4yiaB-5lj3J:
6.04
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.
5mc5 XAA-PRO DIPEPTIDASE

(Homo sapiens) 		no annotation 3 LEU A 435
ARG A 437
ARG A 444
 None
 0.92A 4yiaB-5mc5A:
undetectable		 4yiaB-5mc5A:
17.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5mqp GLYCOSIDE HYDROLASE
BT_1002

(Bacteroides
thetaiotaomicron) 		no annotation 3 LEU A  47
ARG A  48
ARG A  83
 None
 0.89A 4yiaB-5mqpA:
undetectable		 4yiaB-5mqpA:
4.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5n7z LIPOPOLYSACCHARIDE
1,6-GALACTOSYLTRANSF
ERASE

(Salmonella
enterica) 		no annotation 3 LEU A  69
ARG A  71
ARG A  70
 None
 0.90A 4yiaB-5n7zA:
undetectable		 4yiaB-5n7zA:
13.75
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.
5of4 TFIIH BASAL
TRANSCRIPTION FACTOR
COMPLEX HELICASE XPB
SUBUNIT,XPB,TFIIH
BASAL TRANSCRIPTION
FACTOR COMPLEX
HELICASE XPB SUBUNIT
TFIIH BASAL
TRANSCRIPTION FACTOR
COMPLEX HELICASE XPD
SUBUNIT

(Homo sapiens) 		PF04851
(ResIII)
PF06733
(DEAD_2)
PF06777
(HBB)
PF13307
(Helicase_C_2)
PF16203
(ERCC3_RAD25_C) 		3 LEU A 324
ARG A 325
ARG B 497
 None
 0.96A 4yiaB-5of4A:
undetectable		 4yiaB-5of4A:
8.66
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ojs TRANSCRIPTION-ASSOCI
ATED PROTEIN 1

(Saccharomyces
cerevisiae) 		PF00454
(PI3_PI4_kinase)
PF02259
(FAT) 		3 LEU T3314
ARG T3315
ARG T3318
 None
 0.94A 4yiaB-5ojsT:
undetectable		 4yiaB-5ojsT:
1.53
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.
5ow6 VP1

(Cucumber mosaic
virus) 		PF00760
(Cucumo_coat) 		3 LEU A  91
ARG A 181
ARG A  89
 None
 0.82A 4yiaB-5ow6A:
undetectable		 4yiaB-5ow6A:
12.08
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.
5t13 CYANURIC ACID
AMIDOHYDROLASE

(Enterobacter
cloacae) 		PF09663
(Amido_AtzD_TrzD) 		3 LEU A 166
ARG A 195
ARG A  51
 None
None
CO2  A 402 (-4.3A)
 0.89A 4yiaB-5t13A:
undetectable		 4yiaB-5t13A:
6.91
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.
5u0k GLUTAMINASE LIVER
ISOFORM,
MITOCHONDRIAL

(Homo sapiens) 		PF12796
(Ank_2) 		3 LEU A 502
ARG A 504
ARG A 503
 None
 0.96A 4yiaB-5u0kA:
undetectable		 4yiaB-5u0kA:
15.57
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.
5uak CYSTIC FIBROSIS
TRANSMEMBRANE
CONDUCTANCE
REGULATOR

(Homo sapiens) 		PF00005
(ABC_tran)
PF00664
(ABC_membrane)
PF14396
(CFTR_R) 		3 LEU A 293
ARG A 251
ARG A 258
 None
 0.79A 4yiaB-5uakA:
undetectable		 4yiaB-5uakA:
2.97
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.
5van BETA-KLOTHO

(Homo sapiens) 		no annotation 3 LEU A 873
ARG A 874
ARG A 877
 None
 0.84A 4yiaB-5vanA:
undetectable		 4yiaB-5vanA:
25.00
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.
5vf5 SM80.1 VICILIN

(Solanum
melongena) 		no annotation 3 LEU A 172
ARG A 171
ARG A 168
 None
 0.90A 4yiaB-5vf5A:
undetectable		 4yiaB-5vf5A:
15.00
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.
5vrd BIFUNCTIONAL
COENZYME PQQ
SYNTHESIS PROTEIN
C/D

(Methylobacterium
extorquens) 		no annotation 3 LEU D  84
ARG D  86
ARG D  85
 None
 0.90A 4yiaB-5vrdD:
undetectable		 4yiaB-5vrdD:
19.72
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5w99 PBTD

(Planobispora
rosea) 		no annotation 3 LEU A 277
ARG A 278
ARG A 283
 None
 0.85A 4yiaB-5w99A:
undetectable		 4yiaB-5w99A:
19.44
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.
5ws4 MACROLIDE EXPORT
ATP-BINDING/PERMEASE
PROTEIN MACB

(Acinetobacter
baumannii) 		no annotation 3 LEU A  85
ARG A  87
ARG A  86
 None
 0.93A 4yiaB-5ws4A:
undetectable		 4yiaB-5ws4A:
6.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5wuf PUTATIVE MEMBRANE
PROTEIN

(Colwellia
psychrerythraea) 		PF03458
(UPF0126) 		3 LEU A  22
ARG A 135
ARG A  26
 None
 0.91A 4yiaB-5wufA:
undetectable		 4yiaB-5wufA:
10.86
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.
5x49 PROBABLE XAA-PRO
AMINOPEPTIDASE 3

(Homo sapiens) 		PF00557
(Peptidase_M24)
PF05195
(AMP_N) 		3 LEU A 122
ARG A 244
ARG A  75
 None
 0.90A 4yiaB-5x49A:
undetectable		 4yiaB-5x49A:
5.52
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.
6c0d AMIDASE,
HYDANTOINASE/CARBAMO
YLASE FAMILY

(Paraburkholderia
phymatum) 		no annotation 3 LEU A  46
ARG A  32
ARG A  43
 None
 0.84A 4yiaB-6c0dA:
undetectable		 4yiaB-6c0dA:
18.18
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.
6dd6 PHOTOLYASE PHRB

(Agrobacterium
tumefaciens) 		no annotation 3 LEU A 133
ARG A 315
ARG A 311
 None
 0.85A 4yiaB-6dd6A:
undetectable		 4yiaB-6dd6A:
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.
6f5o POLYMERASE BASIC
PROTEIN 2

(Influenza B
virus) 		no annotation 3 LEU C 220
ARG C 142
ARG C 144
 None
 0.89A 4yiaB-6f5oC:
undetectable		 4yiaB-6f5oC:
16.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6fek PROTO-ONCOGENE
TYROSINE-PROTEIN
KINASE RECEPTOR RET

(Homo sapiens) 		no annotation 3 LEU A 816
ARG A 820
ARG A 844
 None
 0.71A 4yiaB-6fekA:
undetectable		 4yiaB-6fekA:
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.
6ghc -

(-) 		no annotation 3 LEU A 125
ARG A 123
ARG A  78
 None
 0.85A 4yiaB-6ghcA:
undetectable		 4yiaB-6ghcA:
undetectable