SIMILAR PATTERNS OF AMINO ACIDS FOR 3SI7_A_ACTA5_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.
1bev BOVINE ENTEROVIRUS
COAT PROTEINS VP1 TO
VP4
BOVINE ENTEROVIRUS
COAT PROTEINS VP1 TO
VP4

(Enterovirus E;
Enterovirus E) 		PF00073
(Rhv)
PF00073
(Rhv) 		3 LYS 2   5
SER 1  47
GLN 1  39
 None
 1.19A 3si7A-1bev2:
undetectable		 3si7A-1bev2:
18.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1d7w MYELOPEROXIDASE

(Homo sapiens) 		PF03098
(An_peroxidase) 		3 LYS C 282
SER C 521
GLN C 524
 None
 1.32A 3si7A-1d7wC:
undetectable		 3si7A-1d7wC:
19.87
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.
1drk D-RIBOSE-BINDING
PROTEIN

(Escherichia
coli) 		PF13407
(Peripla_BP_4) 		3 LYS A 260
SER A 136
GLN A  91
 None
 1.35A 3si7A-1drkA:
undetectable		 3si7A-1drkA:
19.82
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.
1dzt DTDP-4-DEHYDRORHAMNO
SE 3,5-EPIMERASE

(Salmonella
enterica) 		PF00908
(dTDP_sugar_isom) 		3 LYS A  56
SER A 161
GLN A 162
 GOL  A 204 ( 4.1A)
None
None
 0.83A 3si7A-1dztA:
undetectable		 3si7A-1dztA:
21.35
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.
1f2d 1-AMINOCYCLOPROPANE-
1-CARBOXYLATE
DEAMINASE

(Cyberlindnera
saturnus) 		PF00291
(PALP) 		3 LYS A  54
SER A  72
GLN A  80
 PLP  A 342 (-2.7A)
None
None
 1.31A 3si7A-1f2dA:
undetectable		 3si7A-1f2dA:
22.04
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.
1gpe PROTEIN (GLUCOSE
OXIDASE)

(Penicillium
amagasakiense) 		PF00732
(GMC_oxred_N)
PF05199
(GMC_oxred_C) 		3 LYS A 191
SER A 163
GLN A 205
 None
 1.24A 3si7A-1gpeA:
undetectable		 3si7A-1gpeA:
20.79
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.
1h4p GLUCAN
1,3-BETA-GLUCOSIDASE
I/II

(Saccharomyces
cerevisiae) 		PF00150
(Cellulase) 		3 LYS A  41
SER A 216
GLN A 263
 None
 1.18A 3si7A-1h4pA:
0.0		 3si7A-1h4pA:
20.75
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.
1hq8 NKG2-D

(Mus musculus) 		PF00059
(Lectin_C) 		3 LYS A 152
SER A 191
GLN A 194
 None
 0.83A 3si7A-1hq8A:
undetectable		 3si7A-1hq8A:
15.55
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.
1jmm PROTEIN I/II
V-REGION

(Streptococcus
mutans) 		PF08363
(GbpC) 		3 LYS A 739
SER A 753
GLN A 754
 None
 1.23A 3si7A-1jmmA:
undetectable		 3si7A-1jmmA:
21.35
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.
1mfw DOUBLECORTIN-LIKE
KINASE (N-TERMINAL
DOMAIN)

(Homo sapiens) 		PF03607
(DCX) 		3 LYS A 115
SER A 119
GLN A 122
 None
 1.31A 3si7A-1mfwA:
undetectable		 3si7A-1mfwA:
17.13
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.
1nu9 STAPHYLOCOAGULASE

(Staphylococcus
aureus) 		PF08764
(Coagulase) 		3 LYS C 126
SER C  33
GLN C  37
 None
 1.19A 3si7A-1nu9C:
undetectable		 3si7A-1nu9C:
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.
1r76 PECTATE LYASE

(Niveispirillum
irakense) 		PF09492
(Pec_lyase) 		3 LYS A 373
SER A 423
GLN A 419
 None
 1.20A 3si7A-1r76A:
undetectable		 3si7A-1r76A:
20.86
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.
1szb MANNOSE BINDING
LECTIN-ASSOCIATED
SERINE PROTEASE-2
RELATED PROTEIN,
MAP19 (19KDA)

(Homo sapiens) 		PF00431
(CUB)
PF07645
(EGF_CA) 		3 LYS A 110
SER A  79
GLN A  77
 LYS  A 110 ( 0.0A)
SER  A  79 ( 0.0A)
GLN  A  77 ( 0.6A)
 1.12A 3si7A-1szbA:
undetectable		 3si7A-1szbA:
19.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ups GLCNAC-ALPHA-1,4-GAL
-RELEASING
ENDO-BETA-GALACTOSID
ASE

(Clostridium
perfringens) 		PF00722
(Glyco_hydro_16) 		3 LYS A 103
SER A 163
GLN A 154
 None
 0.92A 3si7A-1upsA:
undetectable		 3si7A-1upsA:
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.
1v93 5,10-METHYLENETETRAH
YDROFOLATE REDUCTASE

(Thermus
thermophilus) 		PF02219
(MTHFR) 		3 LYS A 276
SER A 213
GLN A 216
 None
 1.18A 3si7A-1v93A:
undetectable		 3si7A-1v93A:
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.
1vkh PUTATIVE SERINE
HYDROLASE

(Saccharomyces
cerevisiae) 		PF07859
(Abhydrolase_3) 		3 LYS A 124
SER A 131
GLN A 134
 None
 1.02A 3si7A-1vkhA:
undetectable		 3si7A-1vkhA:
19.93
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.
1vko INOSITOL-3-PHOSPHATE
SYNTHASE

(Caenorhabditis
elegans) 		PF01658
(Inos-1-P_synth)
PF07994
(NAD_binding_5) 		3 LYS A 402
SER A 340
GLN A 317
 POP  A 602 (-2.7A)
None
None
 1.32A 3si7A-1vkoA:
undetectable		 3si7A-1vkoA:
18.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1wdn GLUTAMINE BINDING
PROTEIN

(Escherichia
coli) 		PF00497
(SBP_bac_3) 		3 LYS A 125
SER A 116
GLN A 135
 None
 1.34A 3si7A-1wdnA:
undetectable		 3si7A-1wdnA:
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.
1wl1 OCTOPRENYL-DIPHOSPHA
TE SYNTHASE

(Thermotoga
maritima) 		PF00348
(polyprenyl_synt) 		3 LYS A 224
SER A 167
GLN A 201
 None
 0.98A 3si7A-1wl1A:
undetectable		 3si7A-1wl1A:
24.71
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.
1wxq GTP-BINDING PROTEIN

(Pyrococcus
horikoshii) 		PF01926
(MMR_HSR1)
PF02824
(TGS)
PF08438
(MMR_HSR1_C) 		3 LYS A 114
SER A 228
GLN A 231
 None
 0.64A 3si7A-1wxqA:
undetectable		 3si7A-1wxqA:
20.85
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1xfa CYSTIC FIBROSIS
TRANSMEMBRANE
CONDUCTANCE
REGULATOR

(Mus musculus) 		PF00005
(ABC_tran)
PF14396
(CFTR_R) 		3 LYS A 532
SER A 549
GLN A 552
 ACY  A   9 (-2.5A)
ACY  A   9 ( 3.5A)
ACY  A   9 ( 3.9A)
 0.31A 3si7A-1xfaA:
43.8		 3si7A-1xfaA:
99.65
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.
1y3n ALGQ1

(Sphingomonas
sp. A1) 		PF01547
(SBP_bac_1) 		3 LYS A  77
SER A 205
GLN A 310
 None
 1.38A 3si7A-1y3nA:
undetectable		 3si7A-1y3nA:
20.73
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.
1zbp HYPOTHETICAL PROTEIN
VPA1032

(Vibrio
parahaemolyticus) 		PF07024
(ImpE) 		3 LYS A 227
SER A 215
GLN A 218
 None
 1.10A 3si7A-1zbpA:
undetectable		 3si7A-1zbpA:
20.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2asn NITROPHORIN 2

(Rhodnius
prolixus) 		PF02087
(Nitrophorin) 		3 LYS X   9
SER X 150
GLN X 154
 None
 0.79A 3si7A-2asnX:
undetectable		 3si7A-2asnX:
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.
2bco SUCCINYLGLUTAMATE
DESUCCINYLASE

(Vibrio
parahaemolyticus) 		PF04952
(AstE_AspA) 		3 LYS A  54
SER A 178
GLN A 214
 None
 1.16A 3si7A-2bcoA:
undetectable		 3si7A-2bcoA:
23.69
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.
2bl2 V-TYPE SODIUM ATP
SYNTHASE SUBUNIT K

(Enterococcus
hirae) 		PF00137
(ATP-synt_C) 		3 LYS A 123
SER A  47
GLN A  48
 None
 1.26A 3si7A-2bl2A:
undetectable		 3si7A-2bl2A:
19.57
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.
2cmp TERMINASE SMALL
SUBUNIT

(Bacillus phage
SF6) 		PF03592
(Terminase_2) 		3 LYS A  48
SER A   7
GLN A  10
 None
 1.08A 3si7A-2cmpA:
undetectable		 3si7A-2cmpA:
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.
2fji EXOCYST COMPLEX
COMPONENT SEC6

(Saccharomyces
cerevisiae) 		PF06046
(Sec6) 		3 LYS 1 610
SER 1 624
GLN 1 628
 None
 0.89A 3si7A-2fji1:
undetectable		 3si7A-2fji1:
23.90
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.
2g9n EUKARYOTIC
INITIATION FACTOR
4A-I

(Homo sapiens) 		PF00270
(DEAD) 		3 LYS A  83
SER A  56
GLN A  59
 MLY  A  82 ( 3.0A)
None
None
 0.93A 3si7A-2g9nA:
3.9		 3si7A-2g9nA:
23.36
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.
2id1 HYPOTHETICAL PROTEIN

(Chromobacterium
violaceum) 		PF02410
(RsfS) 		3 LYS A  20
SER A  44
GLN A  47
 None
 1.35A 3si7A-2id1A:
undetectable		 3si7A-2id1A:
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.
2j7n RNA-DEPENDENT RNA
POLYMERASE

(Neurospora
crassa) 		PF05183
(RdRP) 		3 LYS A 586
SER A 677
GLN A 673
 None
 1.22A 3si7A-2j7nA:
undetectable		 3si7A-2j7nA:
14.80
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.
2jay PROTEASOME

(Mycobacterium
tuberculosis) 		PF00227
(Proteasome) 		3 LYS A 204
SER A 179
GLN A 194
 None
 1.23A 3si7A-2jayA:
undetectable		 3si7A-2jayA:
19.56
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.
2q1f CHONDROITINASE

(Bacteroides
thetaiotaomicron) 		PF02278
(Lyase_8)
PF09092
(Lyase_N)
PF09093
(Lyase_catalyt) 		3 LYS A 425
SER A 210
GLN A 213
 None
 0.93A 3si7A-2q1fA:
undetectable		 3si7A-2q1fA:
16.25
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.
2wyo GLUTATHIONE
SYNTHETASE

(Trypanosoma
brucei) 		PF03199
(GSH_synthase)
PF03917
(GSH_synth_ATP) 		3 LYS A 223
SER A 303
GLN A 306
 None
 0.65A 3si7A-2wyoA:
undetectable		 3si7A-2wyoA:
20.36
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.
2x27 OUTER MEMBRANE
PROTEIN OPRG

(Pseudomonas
aeruginosa) 		PF03922
(OmpW) 		3 LYS X  59
SER X 109
GLN X 112
 None
 1.29A 3si7A-2x27X:
undetectable		 3si7A-2x27X:
22.33
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.
2yms OUTER MEMBRANE
PROTEIN ASSEMBLY
FACTOR BAMB
OUTER MEMBRANE
PROTEIN ASSEMBLY
FACTOR BAMB

(Escherichia
coli;
Escherichia
coli) 		PF13360
(PQQ_2)
PF13360
(PQQ_2) 		3 LYS A  62
SER D 285
GLN D 301
 None
 1.14A 3si7A-2ymsA:
undetectable		 3si7A-2ymsA:
18.44
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.
2z37 CHITINASE

(Brassica juncea) 		PF00182
(Glyco_hydro_19) 		3 LYS A 199
SER A 152
GLN A 155
 None
 1.24A 3si7A-2z37A:
undetectable		 3si7A-2z37A:
22.26
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.
2zuy YESX PROTEIN

(Bacillus
subtilis) 		PF01839
(FG-GAP) 		3 LYS A 393
SER A 361
GLN A 327
 None
 1.20A 3si7A-2zuyA:
undetectable		 3si7A-2zuyA:
19.70
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.
2zxq ENDO-ALPHA-N-ACETYLG
ALACTOSAMINIDASE

(Bifidobacterium
longum) 		PF12905
(Glyco_hydro_101)
PF17451
(Glyco_hyd_101C) 		3 LYS A 920
SER A 627
GLN A 862
 None
 1.38A 3si7A-2zxqA:
undetectable		 3si7A-2zxqA:
11.78
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.
3b0q PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA

(Homo sapiens) 		PF00104
(Hormone_recep) 		3 LYS A 275
SER A 464
GLN A 283
 None
 1.25A 3si7A-3b0qA:
undetectable		 3si7A-3b0qA:
23.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3dja PROTEIN CT_858

(Chlamydia
trachomatis) 		PF03572
(Peptidase_S41) 		3 LYS A 397
SER A 449
GLN A 453
 None
 1.17A 3si7A-3djaA:
1.8		 3si7A-3djaA:
22.40
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.
3fky GLUTAMINE SYNTHETASE

(Saccharomyces
cerevisiae) 		PF00120
(Gln-synt_C)
PF03951
(Gln-synt_N) 		3 LYS A  46
SER A  50
GLN A  53
 None
 0.98A 3si7A-3fkyA:
undetectable		 3si7A-3fkyA:
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.
3guv SITE-SPECIFIC
RECOMBINASE,
RESOLVASE FAMILY
PROTEIN

(Streptococcus
pneumoniae) 		PF00239
(Resolvase) 		3 LYS A  84
SER A  24
GLN A  28
 None
 1.16A 3si7A-3guvA:
undetectable		 3si7A-3guvA:
20.28
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.
3hdn SERINE/THREONINE-PRO
TEIN KINASE SGK1

(Homo sapiens) 		PF00069
(Pkinase) 		3 LYS A 366
SER A 232
GLN A 233
 None
 1.09A 3si7A-3hdnA:
undetectable		 3si7A-3hdnA:
22.19
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.
3hjz TRANSALDOLASE B

(Prochlorococcus
marinus) 		PF00923
(TAL_FSA) 		3 LYS A 117
SER A  59
GLN A  79
 None
 1.17A 3si7A-3hjzA:
undetectable		 3si7A-3hjzA:
23.25
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.
3i9v NADH-QUINONE
OXIDOREDUCTASE
SUBUNIT 1

(Thermus
thermophilus) 		PF01512
(Complex1_51K)
PF10531
(SLBB)
PF10589
(NADH_4Fe-4S) 		3 LYS 1 250
SER 1 100
GLN 1 253
 None
 1.37A 3si7A-3i9v1:
undetectable		 3si7A-3i9v1:
20.04
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.
3igr RIBOSOMAL-PROTEIN-S5
-ALANINE
N-ACETYLTRANSFERASE

(Aliivibrio
fischeri) 		PF13302
(Acetyltransf_3) 		3 LYS A  75
SER A   4
GLN A  11
 None
 1.38A 3si7A-3igrA:
undetectable		 3si7A-3igrA:
21.07
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.
3ima CYSTEINE PROTEINASE
INHIBITOR

(Colocasia
esculenta) 		PF16845
(SQAPI) 		3 LYS B  85
SER B  52
GLN B  78
 None
 1.25A 3si7A-3imaB:
undetectable		 3si7A-3imaB:
13.38
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.
3kdn RIBULOSE
BISPHOSPHATE
CARBOXYLASE

(Thermococcus
kodakarensis) 		PF00016
(RuBisCO_large)
PF02788
(RuBisCO_large_N) 		3 LYS A 163
SER A 367
GLN A 389
 CAP  A 600 (-3.0A)
CAP  A 600 (-2.5A)
CAP  A 600 (-3.4A)
 0.79A 3si7A-3kdnA:
undetectable		 3si7A-3kdnA:
21.21
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.
3kl0 GLUCURONOXYLANASE
XYNC

(Bacillus
subtilis) 		PF17189
(Glyco_hydro_30C) 		3 LYS A 180
SER A 209
GLN A 210
 None
 1.30A 3si7A-3kl0A:
undetectable		 3si7A-3kl0A:
19.11
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.
3mnz ANTI-HIV-1 ANTIBODY
13H11 LIGHT CHAIN

(Homo sapiens;
Mus musculus) 		PF07654
(C1-set)
PF07686
(V-set) 		3 LYS A 145
SER A 156
GLN A 147
 None
 1.30A 3si7A-3mnzA:
undetectable		 3si7A-3mnzA:
22.68
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.
3opy 6-PHOSPHOFRUCTO-1-KI
NASE ALPHA-SUBUNIT
6-PHOSPHOFRUCTO-1-KI
NASE BETA-SUBUNIT

(Komagataella
pastoris;
Komagataella
pastoris) 		PF00365
(PFK)
PF00365
(PFK) 		3 LYS B 660
SER A  87
GLN A  85
 None
 1.27A 3si7A-3opyB:
undetectable		 3si7A-3opyB:
14.18
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.
3rwa FLUORESCENT PROTEIN
FP480

(Entacmaea
quadricolor) 		PF01353
(GFP) 		3 LYS A  15
SER A  70
GLN A 152
 None
 1.21A 3si7A-3rwaA:
undetectable		 3si7A-3rwaA:
19.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3sbq NITROUS-OXIDE
REDUCTASE

(Pseudomonas
stutzeri) 		no annotation 3 LYS A 164
SER A 602
GLN A 600
 None
 1.14A 3si7A-3sbqA:
undetectable		 3si7A-3sbqA:
17.24
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.
3sy8 ROCR

(Pseudomonas
aeruginosa) 		PF00072
(Response_reg)
PF00563
(EAL) 		3 LYS A 326
SER A 356
GLN A 359
 None
 1.12A 3si7A-3sy8A:
undetectable		 3si7A-3sy8A:
20.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3uuf LIP1, SECRETORY
LIPASE (FAMILY 3)

(Malassezia
globosa) 		PF01764
(Lipase_3) 		3 LYS A  27
SER A 244
GLN A 263
 None
 1.38A 3si7A-3uufA:
undetectable		 3si7A-3uufA:
23.67
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.
3vs8 TYPE III POLYKETIDE
SYNTHASE

(Azotobacter
vinelandii) 		PF02797
(Chal_sti_synt_C) 		3 LYS A 339
SER A  70
GLN A  73
 None
 1.03A 3si7A-3vs8A:
undetectable		 3si7A-3vs8A:
19.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4gpd APO-D-GLYCERALDEHYDE
-3-PHOSPHATE
DEHYDROGENASE

(Homarus
americanus) 		PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C) 		3 LYS 1  68
SER 1   1
GLN 1  25
 None
 1.00A 3si7A-4gpd1:
undetectable		 3si7A-4gpd1:
22.44
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.
4hoz SUCROSE ISOMERASE

(Erwinia
rhapontici) 		PF00128
(Alpha-amylase)
PF16657
(Malt_amylase_C) 		3 LYS A 269
SER A 256
GLN A 259
 None
 1.21A 3si7A-4hozA:
undetectable		 3si7A-4hozA:
19.33
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.
4ife GENE 2 PROTEIN

(Shigella virus
Sf6) 		PF04466
(Terminase_3)
PF17288
(Terminase_3C) 		3 LYS A 434
SER A 211
GLN A 414
 None
 0.76A 3si7A-4ifeA:
4.3		 3si7A-4ifeA:
20.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ll8 MYOSIN-4
SWI5-DEPENDENT HO
EXPRESSION PROTEIN 3

(Saccharomyces
cerevisiae;
Saccharomyces
cerevisiae) 		PF01843
(DIL)
no annotation 		3 LYS A1326
SER E 127
GLN E 131
 None
 1.26A 3si7A-4ll8A:
undetectable		 3si7A-4ll8A:
19.96
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.
4mlk CT584 PROTEIN

(Chlamydia
trachomatis) 		PF17435
(DUF5414) 		3 LYS A  23
SER A  79
GLN A  83
 None
 1.17A 3si7A-4mlkA:
undetectable		 3si7A-4mlkA:
25.69
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.
4nf0 PROBABLE
C4-DICARBOXYLATE-BIN
DING PROTEIN

(Pseudomonas
aeruginosa) 		PF03480
(DctP) 		3 LYS A 151
SER A  93
GLN A 173
 None
LMR  A 401 (-4.0A)
LMR  A 401 (-3.6A)
 1.38A 3si7A-4nf0A:
undetectable		 3si7A-4nf0A:
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.
4oxi ENTEROBACTIN
SYNTHETASE COMPONENT
F-RELATED PROTEIN

(Vibrio cholerae) 		PF00501
(AMP-binding) 		3 LYS A 187
SER A  67
GLN A 179
 None
 1.33A 3si7A-4oxiA:
undetectable		 3si7A-4oxiA:
18.71
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.
4pmh PECTINESTERASE

(Sitophilus
oryzae) 		PF01095
(Pectinesterase) 		3 LYS A 155
SER A 147
GLN A 182
 None
 1.20A 3si7A-4pmhA:
undetectable		 3si7A-4pmhA:
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.
4qqs GLYCOSIDE HYDROLASE
FAMILY 43

(Halothermothrix
orenii) 		PF04616
(Glyco_hydro_43) 		3 LYS A 302
SER A 307
GLN A 309
 None
 1.37A 3si7A-4qqsA:
undetectable		 3si7A-4qqsA:
24.31
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.
4r86 RND FAMILY
AMINOGLYCOSIDE/MULTI
DRUG EFFLUX PUMP

(Salmonella
enterica) 		PF00873
(ACR_tran) 		3 LYS A 258
SER A  49
GLN A  47
 None
 1.10A 3si7A-4r86A:
undetectable		 3si7A-4r86A:
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.
4u02 AMINO ACID ABC
TRANSPORTER,
ATP-BINDING PROTEIN

(Thermus
thermophilus) 		PF00005
(ABC_tran) 		3 LYS A 134
SER A 140
GLN A 143
 None
 1.33A 3si7A-4u02A:
20.1		 3si7A-4u02A:
26.80
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.
4wyr ACETYL-COA
ACETYLTRANSFERASE

(Clostridium
acetobutylicum) 		PF00108
(Thiolase_N)
PF02803
(Thiolase_C) 		3 LYS A 367
SER A 192
GLN A 194
 None
 0.96A 3si7A-4wyrA:
undetectable		 3si7A-4wyrA:
19.95
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.
4ymw ABC-TYPE POLAR AMINO
ACID TRANSPORT
SYSTEM, ATPASE
COMPONENT

(Caldanaerobacter
subterraneus) 		no annotation 3 LYS J 129
SER J 138
GLN J 141
 None
 1.10A 3si7A-4ymwJ:
19.6		 3si7A-4ymwJ:
27.93
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.
4zc3 TERMINASE SMALL
SUBUNIT

(Bacillus phage
SF6) 		PF03592
(Terminase_2) 		3 LYS A  48
SER A   7
GLN A  10
 None
 1.19A 3si7A-4zc3A:
undetectable		 3si7A-4zc3A:
15.22
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.
4zk3 SERPIN B3

(Homo sapiens) 		PF00079
(Serpin) 		3 LYS A 106
SER A 153
GLN A 154
 None
 1.38A 3si7A-4zk3A:
undetectable		 3si7A-4zk3A:
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.
5aza MALTOSE-BINDING
PERIPLASMIC
PROTEIN,OLIGOSACCHAR
YL TRANSFERASE STT3
SUBUNIT RELATED
PROTEIN

(Escherichia
coli;
Pyrococcus
furiosus) 		PF13416
(SBP_bac_8) 		3 LYS A 378
SER A  73
GLN A  72
 None
 1.25A 3si7A-5azaA:
undetectable		 3si7A-5azaA:
15.60
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.
5b7w UPF0234 PROTEIN
XC_3703

(Xanthomonas
campestris) 		PF04461
(DUF520) 		3 LYS A  33
SER A  53
GLN A  56
 None
 0.73A 3si7A-5b7wA:
undetectable		 3si7A-5b7wA:
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.
5cer BD0816
BD3460

(Bdellovibrio
bacteriovorus;
Bdellovibrio
bacteriovorus) 		PF02113
(Peptidase_S13)
PF12796
(Ank_2) 		3 LYS B 214
SER A 402
GLN B 210
 None
 1.29A 3si7A-5cerB:
undetectable		 3si7A-5cerB:
22.34
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.
5dvh PCPI-3

(Solanum
tuberosum) 		PF00197
(Kunitz_legume) 		3 LYS A  66
SER A  73
GLN A  76
 None
 1.27A 3si7A-5dvhA:
undetectable		 3si7A-5dvhA:
20.77
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.
5fsw RNA DEPENDENT RNA
POLYMERASE QDE-1

(Thielavia
terrestris) 		PF05183
(RdRP) 		3 LYS A 209
SER A 299
GLN A 295
 None
 1.32A 3si7A-5fswA:
undetectable		 3si7A-5fswA:
12.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5g4i PHOSPHOLYASE

(Paenarthrobacter
aurescens) 		PF00202
(Aminotran_3) 		3 LYS A 281
SER A 222
GLN A 254
 PLP  A1441 (-1.4A)
None
PO4  A1442 ( 3.3A)
 1.29A 3si7A-5g4iA:
undetectable		 3si7A-5g4iA:
23.56
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.
5gtk BETAINE-ALDEHYDE
DEHYDROGENASE

(Bacillus cereus) 		PF00171
(Aldedh) 		3 LYS A 250
SER A 422
GLN A 468
 None
 1.22A 3si7A-5gtkA:
undetectable		 3si7A-5gtkA:
19.28
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.
5jpn COMPLEMENT C4-A

(Homo sapiens) 		PF01835
(A2M_N)
PF07703
(A2M_N_2) 		3 LYS A 373
SER A 428
GLN A 430
 None
 1.31A 3si7A-5jpnA:
undetectable		 3si7A-5jpnA:
17.74
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.
5k4g L-ASPARAGINASE

(Wolinella
succinogenes) 		PF00710
(Asparaginase) 		3 LYS A 291
SER A 328
GLN A 324
 None
 1.30A 3si7A-5k4gA:
undetectable		 3si7A-5k4gA:
23.34
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.
5k66 NTA1P

(Saccharomyces
cerevisiae) 		PF00795
(CN_hydrolase) 		3 LYS A 382
SER A 372
GLN A 375
 None
 1.28A 3si7A-5k66A:
undetectable		 3si7A-5k66A:
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.
5l25 BORON TRANSPORTER 1

(Arabidopsis
thaliana) 		PF00955
(HCO3_cotransp) 		3 LYS A  91
SER A 466
GLN A 470
 None
 1.27A 3si7A-5l25A:
undetectable		 3si7A-5l25A:
19.91
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.
5lhx SERINE/THREONINE-PRO
TEIN KINASE PLK4

(Drosophila
melanogaster) 		PF00659
(POLO_box) 		3 LYS A 658
SER A 691
GLN A 681
 None
 1.39A 3si7A-5lhxA:
undetectable		 3si7A-5lhxA:
18.30
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.
5mc5 XAA-PRO DIPEPTIDASE

(Homo sapiens) 		no annotation 3 LYS A  92
SER A 138
GLN A 139
 None
 1.37A 3si7A-5mc5A:
undetectable		 3si7A-5mc5A:
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.
5mfa MYELOPEROXIDASE

(Homo sapiens) 		PF03098
(An_peroxidase) 		3 LYS A 448
SER A 687
GLN A 690
 None
 1.32A 3si7A-5mfaA:
undetectable		 3si7A-5mfaA:
17.78
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.
5mtv EH DOMAIN-CONTAINING
PROTEIN 4

(Mus musculus) 		PF00350
(Dynamin_N)
PF16880
(EHD_N) 		3 LYS A 196
SER A 200
GLN A  69
 None
 1.14A 3si7A-5mtvA:
undetectable		 3si7A-5mtvA:
19.28
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.
5tch TRYPTOPHAN SYNTHASE
BETA CHAIN

(Mycobacterium
tuberculosis) 		PF00291
(PALP) 		3 LYS B 395
SER B  99
GLN B 128
 None
LLP  B 101 ( 2.9A)
LLP  B 101 (-3.9A)
 1.17A 3si7A-5tchB:
undetectable		 3si7A-5tchB:
20.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5tcs KINETOCHORE PROTEIN
NDC80

(Saccharomyces
cerevisiae) 		PF03801
(Ndc80_HEC) 		3 LYS A 217
SER A 205
GLN A 206
 None
 1.32A 3si7A-5tcsA:
undetectable		 3si7A-5tcsA:
24.60
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.
5ttk AMINE OXIDASE

(Pseudomonas
putida) 		PF01593
(Amino_oxidase) 		3 LYS A 165
SER A 204
GLN A 207
 None
 1.19A 3si7A-5ttkA:
undetectable		 3si7A-5ttkA:
21.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5uak CYSTIC FIBROSIS
TRANSMEMBRANE
CONDUCTANCE
REGULATOR

(Homo sapiens) 		PF00005
(ABC_tran)
PF00664
(ABC_membrane)
PF14396
(CFTR_R) 		3 LYS A 532
SER A 549
GLN A 552
 None
 0.58A 3si7A-5uakA:
25.1		 3si7A-5uakA:
27.96
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.
5x2g CRISPR-ASSOCIATED
ENDONUCLEASE CAS9

(Campylobacter
jejuni) 		no annotation 3 LYS A 923
SER A 932
GLN A 935
 None
 1.28A 3si7A-5x2gA:
undetectable		 3si7A-5x2gA:
16.53
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.
5xtd NADH DEHYDROGENASE
[UBIQUINONE] 1 ALPHA
SUBCOMPLEX SUBUNIT
10, MITOCHONDRIAL

(Homo sapiens) 		PF06212
(GRIM-19) 		3 LYS w 242
SER w 259
GLN w 257
 None
 1.36A 3si7A-5xtdw:
1.3		 3si7A-5xtdw:
22.06
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.
5yx9 SHORT TRANSIENT
RECEPTOR POTENTIAL
CHANNEL 6

(Homo sapiens) 		no annotation 3 LYS A 874
SER A 282
GLN A 230
 None
 1.36A 3si7A-5yx9A:
undetectable		 3si7A-5yx9A:
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.
5z1q CENTRIN PROTEIN

(Euplotes
octocarinatus) 		no annotation 3 LYS A  94
SER A  22
GLN A  25
 None
 1.38A 3si7A-5z1qA:
undetectable		 3si7A-5z1qA:
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.
6cza -

(-) 		no annotation 3 LYS A 216
SER A  94
GLN A 240
 None
 1.18A 3si7A-6czaA:
undetectable		 3si7A-6czaA:
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.
6egt GLYCOPROTEIN

(Rift Valley
fever
phlebovirus) 		no annotation 3 LYS A 858
SER A 993
GLN A1000
 None
 1.06A 3si7A-6egtA:
undetectable		 3si7A-6egtA:
20.86
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.
6eid ARCHAEAL-TYPE OPSIN
2

(Chlamydomonas
reinhardtii) 		no annotation 3 LYS A  93
SER A  52
GLN A  56
 None
 1.31A 3si7A-6eidA:
undetectable		 3si7A-6eidA:
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.
6emk SERINE/THREONINE-PRO
TEIN KINASE TOR2

(Saccharomyces
cerevisiae) 		no annotation 3 LYS A2257
SER A1382
GLN A1379
 None
 1.28A 3si7A-6emkA:
undetectable		 3si7A-6emkA:
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.
6eti ATP-BINDING CASSETTE
SUB-FAMILY G MEMBER
2

(Homo sapiens) 		no annotation 3 LYS A 369
SER A 468
GLN A 376
 None
 1.26A 3si7A-6etiA:
18.1		 3si7A-6etiA:
undetectable