SIMILAR PATTERNS OF AMINO ACIDS FOR 4K50_I_ACTI506_0

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.
1dow ALPHA-CATENIN
BETA-CATENIN

(Mus musculus;
Mus musculus) 		PF01044
(Vinculin)
no annotation 		3 ARG B 124
LYS A  75
LYS A  78
 None
 1.35A 4k50I-1dowB:
undetectable		 4k50I-1dowB:
6.07
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.
1g59 GLUTAMYL-TRNA
SYNTHETASE

(Thermus
thermophilus) 		PF00749
(tRNA-synt_1c) 		3 ARG A 385
LYS A 386
LYS A 382
 None
 0.85A 4k50I-1g59A:
0.0		 4k50I-1g59A:
21.28
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.
1hnf CD2

(Homo sapiens) 		PF05790
(C2-set)
PF07686
(V-set) 		3 ARG A  48
LYS A  49
LYS A  51
 None
 0.90A 4k50I-1hnfA:
0.0		 4k50I-1hnfA:
18.75
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.
1iur KIAA0730 PROTEIN

(Homo sapiens) 		no annotation 3 ARG A  38
LYS A  35
LYS A  34
 None
 0.93A 4k50I-1iurA:
2.2		 4k50I-1iurA:
10.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1j47 SEX-DETERMINING
REGION Y PROTEIN

(Homo sapiens) 		PF00505
(HMG_box) 		3 ARG A  78
LYS A  79
LYS A  81
 None
 0.90A 4k50I-1j47A:
undetectable		 4k50I-1j47A:
8.70
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1kn1 ALLOPHYCOCYANIN

(Pyropia
yezoensis) 		PF00502
(Phycobilisome) 		3 ARG A  26
LYS A   3
LYS A   7
 None
 1.26A 4k50I-1kn1A:
undetectable		 4k50I-1kn1A:
15.88
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.
1lnl HEMOCYANIN

(Rapana venosa) 		PF00264
(Tyrosinase)
PF14830
(Haemocyan_bet_s) 		3 ARG A 307
LYS A 405
LYS A 303
 None
 1.27A 4k50I-1lnlA:
0.0		 4k50I-1lnlA:
20.45
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.
1m9i ANNEXIN VI

(Homo sapiens) 		PF00191
(Annexin) 		3 ARG A 270
LYS A 262
LYS A 265
 CA  A 702 ( 4.4A)
None
None
 1.09A 4k50I-1m9iA:
0.0		 4k50I-1m9iA:
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.
1mf1 ADENYLOSUCCINATE
SYNTHETASE

(Mus musculus) 		PF00709
(Adenylsucc_synt) 		3 ARG A 385
LYS A 384
LYS A 380
 None
 1.42A 4k50I-1mf1A:
0.0		 4k50I-1mf1A:
22.83
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.
1mzv ADENINE
PHOSPHORIBOSYLTRANSF
ERASE

(Leishmania
tarentolae) 		PF00156
(Pribosyltran) 		3 ARG A 102
LYS A 103
LYS A 106
 None
 0.84A 4k50I-1mzvA:
0.0		 4k50I-1mzvA:
20.22
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.
1qcd ADENINE
PHOSPHORIBOSYLTRANSF
ERASE

(Leishmania
donovani) 		PF00156
(Pribosyltran) 		3 ARG A 102
LYS A 103
LYS A 106
 None
 0.83A 4k50I-1qcdA:
0.0		 4k50I-1qcdA:
20.87
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.
1r5j PUTATIVE
PHOSPHOTRANSACETYLAS
E

(Streptococcus
pyogenes) 		PF01515
(PTA_PTB) 		3 ARG A  91
LYS A  92
LYS A  94
 None
 1.42A 4k50I-1r5jA:
0.0		 4k50I-1r5jA:
21.29
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1tp7 GENOME POLYPROTEIN

(Rhinovirus A) 		PF00680
(RdRP_1) 		3 ARG A 163
LYS A 164
LYS A 167
 None
 1.30A 4k50I-1tp7A:
55.5		 4k50I-1tp7A:
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.
1tuf DIAMINOPIMELATE
DECARBOXYLASE

(Methanocaldococcus
jannaschii) 		PF00278
(Orn_DAP_Arg_deC)
PF02784
(Orn_Arg_deC_N) 		3 ARG A 143
LYS A 121
LYS A 120
 None
 1.19A 4k50I-1tufA:
undetectable		 4k50I-1tufA:
21.79
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.
1ue8 367AA LONG
HYPOTHETICAL
CYTOCHROME P450

(Sulfurisphaera
tokodaii) 		PF00067
(p450) 		3 ARG A  38
LYS A 264
LYS A 266
 None
 1.32A 4k50I-1ue8A:
undetectable		 4k50I-1ue8A:
22.45
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.
1w2b TRIGGER FACTOR

(Escherichia
coli) 		PF05697
(Trigger_N) 		3 ARG 5  45
LYS 5  46
LYS 5  48
 A  01501 ( 2.9A)
None
None
 1.16A 4k50I-1w2b5:
undetectable		 4k50I-1w2b5:
15.01
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.
1wg7 DEDICATOR OF
CYTOKINESIS PROTEIN
9

(Homo sapiens) 		PF00169
(PH) 		3 ARG A  43
LYS A  61
LYS A  70
 None
 1.30A 4k50I-1wg7A:
undetectable		 4k50I-1wg7A:
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.
1x03 SH3-CONTAINING
GRB2-LIKE PROTEIN 2

(Homo sapiens) 		PF03114
(BAR) 		3 ARG A 165
LYS A  28
LYS A  26
 None
 1.01A 4k50I-1x03A:
undetectable		 4k50I-1x03A:
19.09
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.
1x6f ZINC FINGER PROTEIN
462

(Homo sapiens) 		no annotation 3 ARG A  55
LYS A  54
LYS A  57
 None
 1.36A 4k50I-1x6fA:
undetectable		 4k50I-1x6fA:
11.99
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.
1xco PHOSPHATE
ACETYLTRANSFERASE

(Bacillus
subtilis) 		PF01515
(PTA_PTB) 		3 ARG A  89
LYS A  90
LYS A  92
 UVW  A 402 (-2.7A)
None
UVW  A 402 (-2.6A)
 1.14A 4k50I-1xcoA:
undetectable		 4k50I-1xcoA:
21.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1xof BBAHETT1

(-) 		no annotation 3 ARG B 217
LYS B 214
LYS B 213
 None
 1.25A 4k50I-1xofB:
undetectable		 4k50I-1xofB:
10.53
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1xr6 GENOME POLYPROTEIN

(Rhinovirus A) 		PF00680
(RdRP_1) 		3 ARG A 163
LYS A 164
LYS A 167
 None
 0.99A 4k50I-1xr6A:
49.6		 4k50I-1xr6A:
85.22
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.
1y74 PERIPHERAL PLASMA
MEMBRANE PROTEIN
CASK

(Mus musculus) 		PF02828
(L27) 		3 ARG B 108
LYS B 104
LYS B 107
 None
 1.14A 4k50I-1y74B:
undetectable		 4k50I-1y74B:
8.35
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.
1yvl SIGNAL TRANSDUCER
AND ACTIVATOR OF
TRANSCRIPTION
1-ALPHA/BETA

(Homo sapiens) 		PF00017
(SH2)
PF01017
(STAT_alpha)
PF02864
(STAT_bind)
PF02865
(STAT_int) 		3 ARG A 113
LYS A 114
LYS A 110
 None
 1.33A 4k50I-1yvlA:
undetectable		 4k50I-1yvlA:
20.97
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.
2cge ATP-DEPENDENT
MOLECULAR CHAPERONE
HSP82

(Saccharomyces
cerevisiae) 		PF00183
(HSP90) 		3 ARG A 393
LYS A 394
LYS A 390
 None
 1.28A 4k50I-2cgeA:
undetectable		 4k50I-2cgeA:
22.65
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.
2cp9 ELONGATION FACTOR
TS, MITOCHONDRIAL

(Homo sapiens) 		no annotation 3 ARG A  18
LYS A  19
LYS A  15
 None
 1.32A 4k50I-2cp9A:
undetectable		 4k50I-2cp9A:
9.75
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.
2cri VESICLE-ASSOCIATED
MEMBRANE
PROTEIN-ASSOCIATED
PROTEIN A

(Mus musculus) 		PF00635
(Motile_Sperm) 		3 ARG A 127
LYS A 125
LYS A  94
 None
 1.26A 4k50I-2criA:
undetectable		 4k50I-2criA:
17.69
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.
2d16 HYPOTHETICAL PROTEIN
PH1918

(Pyrococcus
horikoshii) 		PF04008
(Adenosine_kin) 		3 ARG A 151
LYS A 148
LYS A 147
 None
 1.32A 4k50I-2d16A:
3.0		 4k50I-2d16A:
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.
2eyn ALPHA-ACTININ 1

(Homo sapiens) 		PF00307
(CH) 		3 ARG A  34
LYS A  35
LYS A  31
 None
 0.92A 4k50I-2eynA:
undetectable		 4k50I-2eynA:
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.
2gax HYPOTHETICAL PROTEIN
ATU0240

(Agrobacterium
fabrum) 		PF09391
(DUF2000) 		3 ARG A  74
LYS A 126
LYS A 129
 None
 1.04A 4k50I-2gaxA:
undetectable		 4k50I-2gaxA:
13.63
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.
2ged SIGNAL RECOGNITION
PARTICLE RECEPTOR
BETA SUBUNIT

(Saccharomyces
cerevisiae) 		PF09439
(SRPRB) 		3 ARG A 231
LYS A 232
LYS A 230
 None
 1.31A 4k50I-2gedA:
undetectable		 4k50I-2gedA:
18.14
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.
2gn1 THREONINE
DEHYDRATASE
CATABOLIC

(Salmonella
enterica) 		PF00291
(PALP) 		3 ARG A  20
LYS A  65
LYS A 157
 None
 0.97A 4k50I-2gn1A:
undetectable		 4k50I-2gn1A:
21.58
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.
2kwc AUTOPHAGY-RELATED
PROTEIN 8

(Saccharomyces
cerevisiae) 		PF02991
(Atg8) 		3 ARG A  47
LYS A  48
LYS A  46
 None
 1.14A 4k50I-2kwcA:
undetectable		 4k50I-2kwcA:
14.97
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.
2ltp NUCLEAR RECEPTOR
COREPRESSOR 2

(Homo sapiens) 		PF00249
(Myb_DNA-binding) 		3 ARG A  67
LYS A  68
LYS A  69
 None
 1.23A 4k50I-2ltpA:
undetectable		 4k50I-2ltpA:
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.
2ml9 YOP PROTEINS
TRANSLOCATION
PROTEIN U

(Yersinia
pseudotuberculosis) 		PF01312
(Bac_export_2) 		3 ARG A 223
LYS A 222
LYS A 226
 None
 0.92A 4k50I-2ml9A:
undetectable		 4k50I-2ml9A:
8.56
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.
2mt6 UBIQUITIN-CONJUGATIN
G ENZYME E2 W

(Homo sapiens) 		PF00179
(UQ_con) 		3 ARG A   7
LYS A   6
LYS A  10
 None
 1.29A 4k50I-2mt6A:
undetectable		 4k50I-2mt6A:
16.59
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.
2och HYPOTHETICAL PROTEIN
DNJ-12

(Caenorhabditis
elegans) 		PF00226
(DnaJ) 		3 ARG A  27
LYS A  28
LYS A  24
 None
 1.18A 4k50I-2ochA:
undetectable		 4k50I-2ochA:
11.81
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.
2qna IMPORTIN SUBUNIT
BETA-1

(Homo sapiens) 		PF13513
(HEAT_EZ) 		3 ARG A 870
LYS A 871
LYS A 867
 None
 1.18A 4k50I-2qnaA:
2.1		 4k50I-2qnaA:
20.10
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.
2vda TRANSLOCASE SUBUNIT
SECA

(Escherichia
coli) 		PF01043
(SecA_PP_bind)
PF07516
(SecA_SW)
PF07517
(SecA_DEAD) 		3 ARG A 201
LYS A 202
LYS A 124
 None
 1.38A 4k50I-2vdaA:
undetectable		 4k50I-2vdaA:
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.
2vki 3-PHOPSHOINOSITIDE
DEPENDENT PROTEIN
KINASE 1

(Homo sapiens) 		PF14593
(PH_3) 		3 ARG A 537
LYS A 538
LYS A 534
 None
 1.23A 4k50I-2vkiA:
undetectable		 4k50I-2vkiA:
15.18
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.
2x0n GLYCERALDEHYDE-3-PHO
SPHATE
DEHYDROGENASE,
GLYCOSOMAL

(Trypanosoma
brucei) 		PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C) 		3 ARG A 278
LYS A 277
LYS A 281
 None
 1.24A 4k50I-2x0nA:
undetectable		 4k50I-2x0nA:
21.81
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.
2yxl 450AA LONG
HYPOTHETICAL FMU
PROTEIN

(Pyrococcus
horikoshii) 		PF01189
(Methyltr_RsmB-F)
PF17125
(Methyltr_RsmF_N) 		3 ARG A 353
LYS A  63
LYS A  62
 None
 1.02A 4k50I-2yxlA:
undetectable		 4k50I-2yxlA:
22.62
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.
2zwk INTIMIN

(Escherichia
coli) 		PF02368
(Big_2)
PF07979
(Intimin_C) 		3 ARG A  24
LYS A  38
LYS A  40
 None
 1.36A 4k50I-2zwkA:
undetectable		 4k50I-2zwkA:
16.67
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.
3c5n TUBBY-RELATED
PROTEIN 1

(Homo sapiens) 		PF01167
(Tub) 		3 ARG A 287
LYS A 267
LYS A 290
 None
 1.40A 4k50I-3c5nA:
undetectable		 4k50I-3c5nA:
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.
3ddr HASR PROTEIN

(Serratia
marcescens) 		PF00593
(TonB_dep_Rec)
PF07715
(Plug) 		3 ARG A 684
LYS A 682
LYS A 650
 None
 0.81A 4k50I-3ddrA:
undetectable		 4k50I-3ddrA:
19.77
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.
3e0k AMINO-ACID
ACETYLTRANSFERASE

(Vibrio
parahaemolyticus) 		PF00583
(Acetyltransf_1) 		3 ARG A 380
LYS A 298
LYS A 345
 None
 1.39A 4k50I-3e0kA:
undetectable		 4k50I-3e0kA:
13.90
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.
3fz0 NUCLEOSIDE
HYDROLASE, PUTATIVE

(Trypanosoma
brucei) 		PF01156
(IU_nuc_hydro) 		3 ARG A 330
LYS A 327
LYS A 328
 None
 1.40A 4k50I-3fz0A:
undetectable		 4k50I-3fz0A:
21.44
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.
3hzn OXYGEN-INSENSITIVE
NAD(P)H
NITROREDUCTASE

(Salmonella
enterica) 		PF00881
(Nitroreductase) 		3 ARG A  73
LYS A  14
LYS A  74
 SIN  A 222 ( 3.1A)
MLI  A 226 ( 4.6A)
MLI  A 226 (-3.4A)
 1.38A 4k50I-3hznA:
undetectable		 4k50I-3hznA:
17.02
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.
3j9o INTRACELLULAR GROWTH
LOCUS PROTEIN A

(Francisella
tularensis) 		PF05591
(T6SS_VipA) 		3 ARG A 113
LYS A 108
LYS A 107
 None
 1.27A 4k50I-3j9oA:
undetectable		 4k50I-3j9oA:
18.10
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.
3jux PROTEIN TRANSLOCASE
SUBUNIT SECA

(Thermotoga
maritima) 		PF00271
(Helicase_C)
PF01043
(SecA_PP_bind)
PF07516
(SecA_SW)
PF07517
(SecA_DEAD) 		3 ARG A   9
LYS A   8
LYS A  12
 None
 1.05A 4k50I-3juxA:
undetectable		 4k50I-3juxA:
21.33
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3k5p D-3-PHOSPHOGLYCERATE
DEHYDROGENASE

(Brucella
abortus) 		PF00389
(2-Hacid_dh)
PF02826
(2-Hacid_dh_C) 		3 ARG A  96
LYS A  97
LYS A  93
 None
 1.29A 4k50I-3k5pA:
undetectable		 4k50I-3k5pA:
22.03
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.
3ksk TYPE-2 RESTRICTION
ENZYME PVUII

(Proteus hauseri) 		PF09225
(Endonuc-PvuII) 		3 ARG A 289
LYS A 290
LYS A 286
 None
 1.04A 4k50I-3kskA:
undetectable		 4k50I-3kskA:
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.
3kyd SUMO-ACTIVATING
ENZYME SUBUNIT 2

(Homo sapiens) 		PF00899
(ThiF)
PF14732
(UAE_UbL) 		3 ARG B 425
LYS B 426
LYS B 427
 None
 1.42A 4k50I-3kydB:
undetectable		 4k50I-3kydB:
22.81
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.
3nqw CG11900

(Drosophila
melanogaster) 		PF13328
(HD_4) 		3 ARG A 101
LYS A 102
LYS A  98
 None
SO4  A 301 (-2.8A)
SO4  A 301 (-3.1A)
 1.22A 4k50I-3nqwA:
undetectable		 4k50I-3nqwA:
17.70
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3r7w GTP-BINDING PROTEIN
GTR1

(Saccharomyces
cerevisiae) 		PF04670
(Gtr1_RagA) 		3 ARG A 113
LYS A 114
LYS A 110
 None
 1.09A 4k50I-3r7wA:
undetectable		 4k50I-3r7wA:
21.94
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.
3sm3 SAM-DEPENDENT
METHYLTRANSFERASES

(Methanosarcina
mazei) 		PF08241
(Methyltransf_11) 		3 ARG A 152
LYS A 153
LYS A 149
 None
 1.08A 4k50I-3sm3A:
undetectable		 4k50I-3sm3A:
21.26
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.
3t32 AMINOTRANSFERASE,
CLASS I/II

(Bacillus
anthracis) 		PF00155
(Aminotran_1_2) 		3 ARG A 377
LYS A 343
LYS A  24
 None
 1.26A 4k50I-3t32A:
undetectable		 4k50I-3t32A:
22.20
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.
3vot L-AMINO ACID LIGASE,
BL00235

(Bacillus
licheniformis) 		PF13535
(ATP-grasp_4) 		3 ARG A   4
LYS A   2
LYS A 319
 None
 1.13A 4k50I-3votA:
undetectable		 4k50I-3votA:
23.60
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.
3vse PUTATIVE
UNCHARACTERIZED
PROTEIN

(Staphylococcus
aureus) 		PF10672
(Methyltrans_SAM) 		3 ARG A 209
LYS A 207
LYS A 206
 None
 1.25A 4k50I-3vseA:
undetectable		 4k50I-3vseA:
22.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3w0k BIFUNCTIONAL
ENDOMANNANASE/ENDOGL
UCANASE

(Caldanaerobius
polysaccharolyticus) 		PF00150
(Cellulase) 		3 ARG A  75
LYS A  26
LYS A  25
 None
 1.35A 4k50I-3w0kA:
undetectable		 4k50I-3w0kA:
20.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4bt1 TRANSCRIPTIONAL
REGULATOR

(Escherichia
virus Mu) 		no annotation 3 ARG A 330
LYS A 331
LYS A 327
 None
 0.92A 4k50I-4bt1A:
undetectable		 4k50I-4bt1A:
8.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4c4a PROTEIN ARGININE
N-METHYLTRANSFERASE
7

(Mus musculus) 		PF06325
(PrmA) 		3 ARG A 441
LYS A 440
LYS A 444
 None
 1.24A 4k50I-4c4aA:
undetectable		 4k50I-4c4aA:
21.06
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4cjm FIBROBLAST GROWTH
FACTOR 18

(Homo sapiens) 		PF00167
(FGF) 		3 ARG A 160
LYS A 161
LYS A 164
 SO4  A1182 (-4.1A)
SO4  A1182 (-4.3A)
SO4  A1182 (-3.4A)
 1.01A 4k50I-4cjmA:
undetectable		 4k50I-4cjmA:
15.56
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.
4dgw PRE-MRNA-SPLICING
FACTOR PRP21
PRE-MRNA-SPLICING
FACTOR PRP11

(Saccharomyces
cerevisiae;
Saccharomyces
cerevisiae) 		PF01805
(Surp)
PF16835
(SF3A2) 		3 ARG B 225
LYS C 239
LYS C 238
 None
 1.16A 4k50I-4dgwB:
undetectable		 4k50I-4dgwB:
17.14
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.
4e4r PHOSPHATE
ACETYLTRANSFERASE

(Staphylococcus
aureus) 		PF01515
(PTA_PTB) 		3 ARG A  89
LYS A  90
LYS A  92
 None
 1.24A 4k50I-4e4rA:
undetectable		 4k50I-4e4rA:
24.59
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.
4eku PROTEIN-TYROSINE
KINASE 2-BETA

(Homo sapiens) 		PF00373
(FERM_M) 		3 ARG A 228
LYS A 229
LYS A 225
 None
 1.33A 4k50I-4ekuA:
undetectable		 4k50I-4ekuA:
21.72
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.
4fl0 AMINOTRANSFERASE
ALD1

(Arabidopsis
thaliana) 		PF00155
(Aminotran_1_2) 		3 ARG A 356
LYS A 357
LYS A 353
 None
 1.32A 4k50I-4fl0A:
undetectable		 4k50I-4fl0A:
22.36
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.
4fvl COLLAGENASE 3

(Homo sapiens) 		PF00045
(Hemopexin)
PF00413
(Peptidase_M10) 		3 ARG A 352
LYS A 381
LYS A 380
 None
 1.34A 4k50I-4fvlA:
undetectable		 4k50I-4fvlA:
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.
4hti RECEPTOR-TYPE
TYROSINE-PROTEIN
PHOSPHATASE N2

(Homo sapiens) 		PF11548
(Receptor_IA-2) 		3 ARG A 511
LYS A 510
LYS A 557
 None
 1.28A 4k50I-4htiA:
3.8		 4k50I-4htiA:
11.55
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4kr9 PROBABLE TRNA
SULFURTRANSFERASE

(Thermotoga
maritima) 		PF02568
(ThiI)
PF02926
(THUMP) 		3 ARG A  29
LYS A  41
LYS A  39
 None
 1.12A 4k50I-4kr9A:
undetectable		 4k50I-4kr9A:
23.79
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.
4rwu PROTEIN SIS1

(Saccharomyces
cerevisiae) 		PF00226
(DnaJ) 		3 ARG A  27
LYS A  28
LYS A  24
 None
 1.33A 4k50I-4rwuA:
undetectable		 4k50I-4rwuA:
12.39
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.
4uhp BACTERIOCIN IMMUNITY
PROTEIN

(Pseudomonas
aeruginosa) 		PF01320
(Colicin_Pyocin) 		3 ARG B  37
LYS B  36
LYS B  40
 None
 1.39A 4k50I-4uhpB:
undetectable		 4k50I-4uhpB:
11.85
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.
4xkq NICKEL ABC
TRANSPORTER
SUBSTRATE-BINDING
PROTEIN

(Staphylococcus
aureus) 		PF00496
(SBP_bac_5) 		3 ARG A 165
LYS A 166
LYS A 162
 None
 1.12A 4k50I-4xkqA:
undetectable		 4k50I-4xkqA:
21.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4zbz URACIL-DNA
GLYCOSYLASE

(Sulfurisphaera
tokodaii) 		PF03167
(UDG) 		3 ARG A 108
LYS A   1
LYS A   6
 None
 1.05A 4k50I-4zbzA:
undetectable		 4k50I-4zbzA:
17.83
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.
5a6d DNA POLYMERASE
SLIDING CLAMP

(Thermococcus
gammatolerans) 		PF00705
(PCNA_N)
PF02747
(PCNA_C) 		3 ARG A  82
LYS A  78
LYS A  81
 None
 1.30A 4k50I-5a6dA:
undetectable		 4k50I-5a6dA:
22.39
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.
5che PROTEIN FLUORESCENT
IN BLUE LIGHT,
CHLOROPLASTIC

(Arabidopsis
thaliana) 		PF13424
(TPR_12) 		3 ARG E 248
LYS E 245
LYS E 244
 None
 1.40A 4k50I-5cheE:
undetectable		 4k50I-5cheE:
16.81
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.
5f84 O-GLUCOSYLTRANSFERAS
E RUMI

(Drosophila
melanogaster) 		PF05686
(Glyco_transf_90) 		3 ARG A 386
LYS A 385
LYS A 389
 None
 1.28A 4k50I-5f84A:
undetectable		 4k50I-5f84A:
21.63
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.
5f9o CLADE A/E 93TH057
HIV-1 GP120 CORE

(Human
immunodeficiency
virus 1) 		PF00516
(GP120) 		3 ARG G 327
LYS G 328
LYS G 325
 EPE  G 514 ( 4.0A)
None
None
 1.36A 4k50I-5f9oG:
undetectable		 4k50I-5f9oG:
20.93
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.
5h7j ELONGATION FACTOR 2

(Pyrococcus
horikoshii) 		no annotation 3 ARG A 536
LYS A 523
LYS A 519
 None
 1.38A 4k50I-5h7jA:
undetectable		 4k50I-5h7jA:
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.
5he9 HELICASE LOADER

(Staphylococcus
aureus) 		PF01695
(IstB_IS21) 		3 ARG A 187
LYS A 185
LYS A 182
 None
 1.18A 4k50I-5he9A:
undetectable		 4k50I-5he9A:
17.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5iq6 RNA DEPENDENT RNA
POLYMERASE

(Dengue virus) 		PF00972
(Flavi_NS5) 		3 ARG A 739
LYS A 329
LYS A 325
 None
 1.31A 4k50I-5iq6A:
8.2		 4k50I-5iq6A:
20.99
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.
5jxd TUMOR NECROSIS
FACTOR ALPHA-INDUCED
PROTEIN 8

(Mus musculus) 		PF05527
(DUF758) 		3 ARG A 154
LYS A  73
LYS A  77
 None
 1.23A 4k50I-5jxdA:
undetectable		 4k50I-5jxdA:
19.78
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.
5kzt PEPTIDE/NICKEL
TRANSPORT SYSTEM
SUBSTRATE-BINDING
PROTEIN

(Listeria
monocytogenes) 		PF00496
(SBP_bac_5) 		3 ARG A 324
LYS A 325
LYS A 321
 None
 1.07A 4k50I-5kztA:
undetectable		 4k50I-5kztA:
21.95
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.
5lm2 TYROSINE-PROTEIN
PHOSPHATASE
NON-RECEPTOR TYPE 23

(Homo sapiens) 		PF13949
(ALIX_LYPXL_bnd) 		3 ARG A 210
LYS A  26
LYS A  30
 None
 1.11A 4k50I-5lm2A:
undetectable		 4k50I-5lm2A:
21.94
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.
5odd MEDIATOR OF RNA
POLYMERASE II
TRANSCRIPTION
SUBUNIT 26

(Homo sapiens) 		no annotation 3 ARG A  78
LYS A  75
LYS A  74
 None
 1.20A 4k50I-5oddA:
undetectable		 4k50I-5oddA:
10.96
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.
5of4 TFIIH BASAL
TRANSCRIPTION FACTOR
COMPLEX HELICASE XPB
SUBUNIT,XPB,TFIIH
BASAL TRANSCRIPTION
FACTOR COMPLEX
HELICASE XPB SUBUNIT

(Homo sapiens) 		PF04851
(ResIII)
PF16203
(ERCC3_RAD25_C) 		3 ARG A 325
LYS A 326
LYS A 322
 None
 1.34A 4k50I-5of4A:
undetectable		 4k50I-5of4A:
20.49
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.
5ofu FBP PROTEIN

(Leishmania
major) 		PF00316
(FBPase) 		3 ARG A 325
LYS A 211
LYS A 210
 None
 1.41A 4k50I-5ofuA:
undetectable		 4k50I-5ofuA:
23.49
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.
5olp PECTATE LYASE

(Bacteroides
thetaiotaomicron) 		no annotation 3 ARG A 419
LYS A 444
LYS A 421
 None
 1.39A 4k50I-5olpA:
undetectable		 4k50I-5olpA:
23.09
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.
5udb DNA REPLICATION
LICENSING FACTOR
MCM6

(Saccharomyces
cerevisiae) 		PF00493
(MCM)
PF14551
(MCM_N)
PF17207
(MCM_OB) 		3 ARG 6 967
LYS 6 966
LYS 6 970
 None
 1.31A 4k50I-5udb6:
undetectable		 4k50I-5udb6:
18.94
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.
5wy3 PUTATIVE
UNCHARACTERIZED
PROTEIN

(Chaetomium
thermophilum) 		no annotation 3 ARG A 139
LYS A 136
LYS A 135
 None
 1.36A 4k50I-5wy3A:
2.4		 4k50I-5wy3A:
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.
5xym 50S RIBOSOMAL
PROTEIN L2

(Mycolicibacterium
smegmatis) 		PF00181
(Ribosomal_L2)
PF03947
(Ribosomal_L2_C) 		3 ARG C 258
LYS C 259
LYS C 262
 G  A2019 ( 3.7A)
U  A2311 ( 3.8A)
A  A2023 ( 3.4A)
 1.22A 4k50I-5xymC:
undetectable		 4k50I-5xymC:
17.93
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.
5y50 PROTEIN
DETOXIFICATION 14

(Arabidopsis
thaliana) 		no annotation 3 ARG A 461
LYS A 462
LYS A 458
 None
 1.17A 4k50I-5y50A:
1.3		 4k50I-5y50A:
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.
5yw5 ADENINE
PHOSPHORIBOSYLTRANSF
ERASE

(Francisella
tularensis) 		no annotation 3 ARG A  83
LYS A  84
LYS A  87
 None
 1.21A 4k50I-5yw5A:
undetectable		 4k50I-5yw5A:
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.
5z8l -

(-) 		no annotation 3 ARG A  16
LYS A  63
LYS A  65
 None
 1.13A 4k50I-5z8lA:
undetectable		 4k50I-5z8lA:
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.
6azp MYELOPEROXIDASE

(Homo sapiens) 		no annotation 3 ARG A 628
LYS A 629
LYS A 625
 None
 1.37A 4k50I-6azpA:
undetectable		 4k50I-6azpA:
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.
6b8p POTASSIUM
VOLTAGE-GATED
CHANNEL SUBFAMILY
KQT MEMBER 4

(Homo sapiens) 		no annotation 3 ARG A 547
LYS A 546
LYS A 550
 None
 1.33A 4k50I-6b8pA:
undetectable		 4k50I-6b8pA:
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.
6bv2 AMINOPEPTIDASE N

(Sus scrofa) 		no annotation 3 ARG A 720
LYS A 721
LYS A 717
 SO4  A1029 (-2.4A)
None
None
 1.37A 4k50I-6bv2A:
0.0		 4k50I-6bv2A:
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.
6cmo CHIMERA PROTEIN OF
SOLUBLE CYTOCHROME
B562 AND RHODOPSIN

(Escherichia
coli;
Homo sapiens) 		no annotation 3 ARG R  69
LYS R  67
LYS R  66
 None
 1.36A 4k50I-6cmoR:
undetectable		 4k50I-6cmoR:
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.
6d2q FERM, RHOGEF
(ARHGEF) AND
PLECKSTRIN DOMAIN
PROTEIN 1
(CHONDROCYTE-DERIVED
)

(Danio rerio) 		no annotation 3 ARG A 268
LYS A 269
LYS A 280
 None
 1.28A 4k50I-6d2qA:
undetectable		 4k50I-6d2qA:
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.
6g5i SERINE/THREONINE-PRO
TEIN KINASE RIO1

(Homo sapiens) 		no annotation 3 ARG z 534
LYS z 535
LYS z 531
 None
G  21043 ( 2.7A)
G  21044 ( 4.1A)
 1.02A 4k50I-6g5iz:
undetectable		 4k50I-6g5iz:
undetectable