SIMILAR PATTERNS OF AMINO ACIDS FOR 3LSL_D_PZID801

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.
1dcq PYK2-ASSOCIATED
PROTEIN BETA

(Mus musculus) 		PF01412
(ArfGap)
PF12796
(Ank_2) 		4 ASN A 322
ILE A 320
SER A 276
GLY A 280
 None
 0.84A 3lslA-1dcqA:
undetectable
3lslD-1dcqA:
undetectable		 3lslA-1dcqA:
20.07
3lslD-1dcqA:
20.07
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.
1dcq PYK2-ASSOCIATED
PROTEIN BETA

(Mus musculus) 		PF01412
(ArfGap)
PF12796
(Ank_2) 		4 ASN A 326
ILE A 320
SER A 276
GLY A 280
 None
 0.91A 3lslA-1dcqA:
undetectable
3lslD-1dcqA:
undetectable		 3lslA-1dcqA:
20.07
3lslD-1dcqA:
20.07
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.
1e5m BETA KETOACYL ACYL
CARRIER PROTEIN
SYNTHASE II

(Synechocystis
sp. PCC 6803) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C) 		5 SER A 400
ASN A 305
ILE A 352
SER A 171
GLY A 351
 None
 1.34A 3lslA-1e5mA:
0.8
3lslD-1e5mA:
0.0		 3lslA-1e5mA:
20.96
3lslD-1e5mA:
20.96
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.
1h79 ANAEROBIC
RIBONUCLEOTIDE-TRIPH
OSPHATE REDUCTASE
LARGE CHAIN

(Escherichia
virus T4) 		PF13597
(NRDD) 		5 SER A 292
ASN A 310
SER A 398
SER A 396
GLY A 313
 None
 0.97A 3lslA-1h79A:
undetectable
3lslD-1h79A:
undetectable		 3lslA-1h79A:
19.25
3lslD-1h79A:
19.25
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.
1hxm GAMMA-DELTA T-CELL
RECEPTOR

(Homo sapiens) 		PF07654
(C1-set)
PF07686
(V-set) 		4 ASN A 176
ILE A 169
PRO A 119
GLY A 173
 None
 0.90A 3lslA-1hxmA:
undetectable
3lslD-1hxmA:
undetectable		 3lslA-1hxmA:
21.66
3lslD-1hxmA:
21.66
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.
1hyg L-LACTATE/MALATE
DEHYDROGENASE

(Methanocaldococcus
jannaschii) 		PF00056
(Ldh_1_N)
PF02866
(Ldh_1_C) 		4 SER A  37
ILE A   6
SER A   9
GLY A   7
 NAP  A 900 (-2.5A)
None
NAP  A 900 (-2.7A)
NAP  A 900 (-2.5A)
 0.94A 3lslA-1hygA:
undetectable
3lslD-1hygA:
undetectable		 3lslA-1hygA:
22.12
3lslD-1hygA:
22.12
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.
1ig8 HEXOKINASE PII

(Saccharomyces
cerevisiae) 		PF00349
(Hexokinase_1)
PF03727
(Hexokinase_2) 		4 SER A 158
ILE A 467
SER A 460
GLY A 214
 None
 0.86A 3lslA-1ig8A:
undetectable
3lslD-1ig8A:
undetectable		 3lslA-1ig8A:
18.40
3lslD-1ig8A:
18.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1lrw METHANOL
DEHYDROGENASE
SUBUNIT 1

(Paracoccus
denitrificans) 		PF01011
(PQQ)
PF13360
(PQQ_2) 		4 SER A 558
ASN A 394
ILE A 517
GLY A 539
 None
PQQ  A 701 ( 3.9A)
None
PQQ  A 701 (-3.4A)
 0.79A 3lslA-1lrwA:
undetectable
3lslD-1lrwA:
undetectable		 3lslA-1lrwA:
17.30
3lslD-1lrwA:
17.30
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.
1m0w GLUTATHIONE
SYNTHETASE

(Saccharomyces
cerevisiae) 		PF03199
(GSH_synthase)
PF03917
(GSH_synth_ATP) 		4 SER A 321
ILE A 126
PRO A 314
GLY A 125
 None
 0.93A 3lslA-1m0wA:
undetectable
3lslD-1m0wA:
0.0		 3lslA-1m0wA:
21.43
3lslD-1m0wA:
21.43
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.
1r9j TRANSKETOLASE

(Leishmania
mexicana) 		PF00456
(Transketolase_N)
PF02779
(Transket_pyr)
PF02780
(Transketolase_C) 		4 SER A 527
ILE A 489
SER A 492
SER A 576
 None
 0.93A 3lslA-1r9jA:
undetectable
3lslD-1r9jA:
undetectable		 3lslA-1r9jA:
16.96
3lslD-1r9jA:
16.96
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.
1s4c PROTEIN HI0227

(Haemophilus
influenzae) 		PF04074
(DUF386) 		4 PRO A  88
ILE A 108
PRO A 129
GLY A  84
 None
 0.94A 3lslA-1s4cA:
undetectable
3lslD-1s4cA:
undetectable		 3lslA-1s4cA:
20.48
3lslD-1s4cA:
20.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1uap PROCOLLAGEN
C-PROTEINASE
ENHANCER PROTEIN

(Homo sapiens) 		PF01759
(NTR) 		4 SER A  24
PRO A 125
SER A  48
GLY A 114
 None
 0.96A 3lslA-1uapA:
undetectable
3lslD-1uapA:
undetectable		 3lslA-1uapA:
19.69
3lslD-1uapA:
19.69
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.
1v5f PYRUVATE OXIDASE

(Aerococcus
viridans) 		PF00205
(TPP_enzyme_M)
PF02775
(TPP_enzyme_C)
PF02776
(TPP_enzyme_N) 		4 ASN A  87
ILE A 419
PRO A 422
GLY A 418
 TPP  A1602 ( 4.8A)
None
None
None
 0.85A 3lslA-1v5fA:
2.3
3lslD-1v5fA:
undetectable		 3lslA-1v5fA:
19.06
3lslD-1v5fA:
19.06
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.
1vbg PYRUVATE,ORTHOPHOSPH
ATE DIKINASE

(Zea mays) 		PF00391
(PEP-utilizers)
PF01326
(PPDK_N)
PF02896
(PEP-utilizers_C) 		4 ILE A 609
PRO A 546
SER A 604
GLY A 608
 None
 0.95A 3lslA-1vbgA:
undetectable
3lslD-1vbgA:
undetectable		 3lslA-1vbgA:
14.39
3lslD-1vbgA:
14.39
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.
1vkd CONSERVED
HYPOTHETICAL PROTEIN
TM1225

(Thermotoga
maritima) 		PF04041
(Glyco_hydro_130) 		4 ASN A 210
ILE A 213
SER A 243
GLY A 232
 None
 0.86A 3lslA-1vkdA:
undetectable
3lslD-1vkdA:
undetectable		 3lslA-1vkdA:
21.94
3lslD-1vkdA:
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.
1w27 PHENYLALANINE
AMMONIA-LYASE 1

(Petroselinum
crispum) 		PF00221
(Lyase_aromatic) 		4 SER A 210
ASN A 221
PRO A 195
GLY A 141
 None
 0.94A 3lslA-1w27A:
undetectable
3lslD-1w27A:
undetectable		 3lslA-1w27A:
17.39
3lslD-1w27A:
17.39
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.
1yx2 AMINOMETHYLTRANSFERA
SE

(Bacillus
subtilis) 		PF01571
(GCV_T)
PF08669
(GCV_T_C) 		4 ASN A  72
ILE A 255
PRO A 250
GLY A 256
 None
 0.89A 3lslA-1yx2A:
undetectable
3lslD-1yx2A:
undetectable		 3lslA-1yx2A:
22.88
3lslD-1yx2A:
22.88
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.
1zcc GLYCEROPHOSPHODIESTE
R PHOSPHODIESTERASE

(Agrobacterium
fabrum) 		PF03009
(GDPD) 		4 SER A 134
ILE A 146
PRO A 114
GLY A 142
 None
 0.91A 3lslA-1zccA:
undetectable
3lslD-1zccA:
undetectable		 3lslA-1zccA:
22.30
3lslD-1zccA:
22.30
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.
1zwx SPHINGOMYELINASE-C

(Listeria
ivanovii) 		PF03372
(Exo_endo_phos) 		4 PRO A 111
ILE A 113
SER A 116
GLY A 114
 None
 0.94A 3lslA-1zwxA:
undetectable
3lslD-1zwxA:
undetectable		 3lslA-1zwxA:
20.13
3lslD-1zwxA:
20.13
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.
2aj4 GALACTOKINASE

(Saccharomyces
cerevisiae) 		PF00288
(GHMP_kinases_N)
PF08544
(GHMP_kinases_C)
PF10509
(GalKase_gal_bdg) 		4 PRO A 150
ASN A 186
PRO A  89
GLY A 153
 None
 0.91A 3lslA-2aj4A:
undetectable
3lslD-2aj4A:
undetectable		 3lslA-2aj4A:
19.56
3lslD-2aj4A:
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.
2bg9 ACETYLCHOLINE
RECEPTOR PROTEIN,
ALPHA CHAIN
ACETYLCHOLINE
RECEPTOR PROTEIN,
BETA CHAIN
ACETYLCHOLINE
RECEPTOR PROTEIN,
DELTA CHAIN

(Torpedo
marmorata;
Torpedo
marmorata;
Torpedo
marmorata) 		PF02931
(Neur_chan_LBD)
PF02932
(Neur_chan_memb)
PF02931
(Neur_chan_LBD)
PF02932
(Neur_chan_memb)
PF02931
(Neur_chan_LBD)
PF02932
(Neur_chan_memb) 		4 SER C 258
ILE A 247
SER B 250
SER B 254
 None
 0.92A 3lslA-2bg9C:
undetectable
3lslD-2bg9C:
undetectable		 3lslA-2bg9C:
21.53
3lslD-2bg9C:
21.53
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.
2c11 MEMBRANE COPPER
AMINE OXIDASE

(Homo sapiens) 		PF01179
(Cu_amine_oxid)
PF02727
(Cu_amine_oxidN2)
PF02728
(Cu_amine_oxidN3) 		4 PRO A 653
SER A 620
PRO A 215
GLY A 217
 None
 0.85A 3lslA-2c11A:
undetectable
3lslD-2c11A:
undetectable		 3lslA-2c11A:
15.31
3lslD-2c11A:
15.31
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.
2c1d SOXA

(Paracoccus
denitrificans) 		no annotation 4 ILE A  61
PRO A  51
SER A 276
GLY A 278
 None
 0.87A 3lslA-2c1dA:
undetectable
3lslD-2c1dA:
undetectable		 3lslA-2c1dA:
17.54
3lslD-2c1dA:
17.54
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.
2fj0 CARBOXYLIC ESTER
HYDROLASE

(Manduca sexta) 		PF00135
(COesterase) 		5 ASN A 271
ILE A 288
PRO A 285
SER A 187
SER A 184
 None
 1.47A 3lslA-2fj0A:
undetectable
3lslD-2fj0A:
undetectable		 3lslA-2fj0A:
18.92
3lslD-2fj0A:
18.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2frv PERIPLASMIC
HYDROGENASE

(Desulfovibrio
gigas) 		no annotation 4 PRO L 529
ILE L  14
SER L  37
SER L  39
 None
 0.78A 3lslA-2frvL:
undetectable
3lslD-2frvL:
undetectable		 3lslA-2frvL:
20.98
3lslD-2frvL:
20.98
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.
2gpr GLUCOSE-PERMEASE IIA
COMPONENT

(Mycoplasma
capricolum) 		PF00358
(PTS_EIIA_1) 		4 PRO A  47
ILE A  84
SER A 126
GLY A  85
 None
 0.82A 3lslA-2gprA:
undetectable
3lslD-2gprA:
undetectable		 3lslA-2gprA:
20.92
3lslD-2gprA:
20.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2h6o MAJOR OUTER ENVELOPE
GLYCOPROTEIN GP350

(Human
gammaherpesvirus
4) 		PF05109
(Herpes_BLLF1) 		4 PRO A 290
SER A 286
SER A 197
GLY A 287
 NAG  A1195 (-4.0A)
None
None
None
 0.96A 3lslA-2h6oA:
undetectable
3lslD-2h6oA:
undetectable		 3lslA-2h6oA:
19.40
3lslD-2h6oA:
19.40
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.
2la7 UNCHARACTERIZED
PROTEIN

(Paraburkholderia
xenovorans) 		PF03724
(META) 		4 ASN A  72
ILE A 104
PRO A  44
GLY A 101
 None
 0.63A 3lslA-2la7A:
undetectable
3lslD-2la7A:
undetectable		 3lslA-2la7A:
19.77
3lslD-2la7A:
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.
2nux 2-KETO-3-DEOXYGLUCON
ATE/2-KETO-3-DEOXY-6
-PHOSPHO GLUCONATE
ALDOLASE

(Sulfolobus
acidocaldarius) 		PF00701
(DHDPS) 		5 ASN A  88
ILE A  92
SER A 125
SER A 122
GLY A  94
 None
 1.40A 3lslA-2nuxA:
undetectable
3lslD-2nuxA:
undetectable		 3lslA-2nuxA:
22.48
3lslD-2nuxA:
22.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2o2c GLUCOSE-6-PHOSPHATE
ISOMERASE,
GLYCOSOMAL

(Trypanosoma
brucei) 		PF00342
(PGI) 		4 ILE A 337
PRO A 336
SER A 328
GLY A 334
 None
 0.90A 3lslA-2o2cA:
undetectable
3lslD-2o2cA:
undetectable		 3lslA-2o2cA:
18.35
3lslD-2o2cA:
18.35
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.
2p8t HYPOTHETICAL PROTEIN
PH0730

(Pyrococcus
horikoshii) 		PF14544
(DUF4443) 		4 PRO A 172
ILE A  98
SER A  91
GLY A  89
 None
 0.94A 3lslA-2p8tA:
undetectable
3lslD-2p8tA:
undetectable		 3lslA-2p8tA:
24.90
3lslD-2p8tA:
24.90
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.
2pbf PROTEIN-L-ISOASPARTA
TE
O-METHYLTRANSFERASE
BETA-ASPARTATE
METHYLTRANSFERASE

(Plasmodium
falciparum) 		PF01135
(PCMT) 		4 ILE A 191
PRO A 176
SER A 173
SER A 223
 None
 0.88A 3lslA-2pbfA:
undetectable
3lslD-2pbfA:
undetectable		 3lslA-2pbfA:
21.38
3lslD-2pbfA:
21.38
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.
2pgg RNA-DIRECTED RNA
POLYMERASE

(Infectious
bursal disease
virus) 		PF04197
(Birna_RdRp) 		4 PRO A 320
ILE A 472
PRO A 112
SER A 339
 None
 0.88A 3lslA-2pggA:
undetectable
3lslD-2pggA:
undetectable		 3lslA-2pggA:
16.43
3lslD-2pggA:
16.43
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.
2raa PYRUVATE SYNTHASE
SUBUNIT PORC

(Thermotoga
maritima) 		PF01558
(POR) 		4 PRO A 140
ASN A 101
ILE A 136
GLY A 135
 None
 0.94A 3lslA-2raaA:
undetectable
3lslD-2raaA:
undetectable		 3lslA-2raaA:
21.69
3lslD-2raaA:
21.69
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.
2rcb GLUTAMATE [NMDA]
RECEPTOR SUBUNIT 3B

(Rattus
norvegicus) 		PF10613
(Lig_chan-Glu_bd) 		4 ILE A 124
PRO A 137
SER A 140
GLY A 249
 None
 0.72A 3lslA-2rcbA:
30.3
3lslD-2rcbA:
30.0		 3lslA-2rcbA:
29.63
3lslD-2rcbA:
29.63
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.
2rcy PYRROLINE
CARBOXYLATE
REDUCTASE

(Plasmodium
falciparum) 		PF03807
(F420_oxidored)
PF14748
(P5CR_dimer) 		4 PRO A 117
PRO A 170
SER A 166
GLY A 167
 None
None
None
NAP  A 264 ( 4.8A)
 0.90A 3lslA-2rcyA:
undetectable
3lslD-2rcyA:
undetectable		 3lslA-2rcyA:
24.57
3lslD-2rcyA:
24.57
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.
2wae PENICILLIN-BINDING
PROTEIN 2B

(Streptococcus
pneumoniae) 		PF00905
(Transpeptidase)
PF03717
(PBP_dimer) 		4 ILE A 493
PRO A 544
SER A 489
GLY A 492
 None
 0.93A 3lslA-2waeA:
undetectable
3lslD-2waeA:
undetectable		 3lslA-2waeA:
19.10
3lslD-2waeA:
19.10
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.
2z2i PEPTIDYL-TRNA
HYDROLASE

(Mycobacterium
tuberculosis) 		PF01195
(Pept_tRNA_hydro) 		4 PRO A  65
ASN A  12
SER A 120
GLY A 117
 None
 0.86A 3lslA-2z2iA:
undetectable
3lslD-2z2iA:
undetectable		 3lslA-2z2iA:
20.85
3lslD-2z2iA:
20.85
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2zns GLUTAMATE RECEPTOR,
IONOTROPIC KAINATE 1

(Homo sapiens) 		PF10613
(Lig_chan-Glu_bd) 		4 ILE A 504
PRO A 517
SER A 746
GLY A 748
 None
 0.23A 3lslA-2znsA:
37.4
3lslD-2znsA:
37.0		 3lslA-2znsA:
51.92
3lslD-2znsA:
51.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3a1f CYTOCHROME B-245
HEAVY CHAIN

(Homo sapiens) 		PF08030
(NAD_binding_6) 		4 SER A  38
ILE A   1
SER A  11
GLY A   8
 None
NI  A 193 (-4.0A)
None
None
 0.85A 3lslA-3a1fA:
undetectable
3lslD-3a1fA:
undetectable		 3lslA-3a1fA:
20.46
3lslD-3a1fA:
20.46
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.
3aqk POLY(A) POLYMERASE

(Escherichia
coli) 		PF01743
(PolyA_pol)
PF12626
(PolyA_pol_arg_C)
PF12627
(PolyA_pol_RNAbd) 		4 PRO A 187
ILE A 220
PRO A 219
SER A 213
 None
 0.96A 3lslA-3aqkA:
undetectable
3lslD-3aqkA:
undetectable		 3lslA-3aqkA:
21.00
3lslD-3aqkA:
21.00
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.
3ayq LYSOZYME

(Meretrix
lusoria) 		PF05497
(Destabilase) 		4 PRO A  51
ILE A  40
SER A  61
SER A  57
 None
NAG  A 125 (-4.4A)
None
None
 0.84A 3lslA-3ayqA:
undetectable
3lslD-3ayqA:
undetectable		 3lslA-3ayqA:
17.18
3lslD-3ayqA:
17.18
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.
3b70 ENOYL REDUCTASE

(Aspergillus
terreus) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		5 SER A 352
ILE A 239
SER A 174
SER A 197
GLY A 172
 NAP  A 372 (-2.6A)
NAP  A 372 ( 4.2A)
NAP  A 372 (-2.6A)
NAP  A 372 (-2.5A)
None
 1.41A 3lslA-3b70A:
undetectable
3lslD-3b70A:
undetectable		 3lslA-3b70A:
22.13
3lslD-3b70A:
22.13
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.
3c4q PREDICTED
GLYCOSYLTRANSFERASES

(Corynebacterium
glutamicum) 		PF00534
(Glycos_transf_1)
PF13439
(Glyco_transf_4) 		4 PRO A 195
ILE A 342
SER A 317
GLY A 339
 None
 0.84A 3lslA-3c4qA:
undetectable
3lslD-3c4qA:
undetectable		 3lslA-3c4qA:
21.26
3lslD-3c4qA:
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.
3fds DNA POLYMERASE
SLIDING CLAMP C

(Sulfolobus
solfataricus) 		PF00705
(PCNA_N)
PF02747
(PCNA_C) 		4 PRO D 122
ILE D  40
SER D  38
GLY D  39
 None
 0.92A 3lslA-3fdsD:
undetectable
3lslD-3fdsD:
undetectable		 3lslA-3fdsD:
24.04
3lslD-3fdsD:
24.04
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.
3g0t PUTATIVE
AMINOTRANSFERASE

(Porphyromonas
gingivalis) 		PF00155
(Aminotran_1_2) 		4 SER A 257
ILE A  60
PRO A  58
GLY A  61
 None
 0.78A 3lslA-3g0tA:
undetectable
3lslD-3g0tA:
undetectable		 3lslA-3g0tA:
20.50
3lslD-3g0tA:
20.50
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.
3g8y SUSD/RAGB-ASSOCIATED
ESTERASE-LIKE
PROTEIN

(Bacteroides
vulgatus) 		PF12715
(Abhydrolase_7) 		4 ILE A 143
PRO A 261
SER A 146
GLY A 258
 None
 0.88A 3lslA-3g8yA:
undetectable
3lslD-3g8yA:
undetectable		 3lslA-3g8yA:
20.55
3lslD-3g8yA:
20.55
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3h6t GLUTAMATE RECEPTOR 2

(Rattus
norvegicus) 		PF10613
(Lig_chan-Glu_bd) 		4 ILE A  92
PRO A 105
SER A 108
GLY A 219
 None
CYZ  A 265 (-3.9A)
CYZ  A 265 (-2.8A)
None
 0.27A 3lslA-3h6tA:
42.6
3lslD-3h6tA:
42.7		 3lslA-3h6tA:
99.61
3lslD-3h6tA:
99.61
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3h6t GLUTAMATE RECEPTOR 2

(Rattus
norvegicus) 		PF10613
(Lig_chan-Glu_bd) 		4 ILE A  92
PRO A 105
SER A 217
GLY A 219
 None
CYZ  A 265 (-3.9A)
GOL  A 270 ( 3.0A)
None
 0.68A 3lslA-3h6tA:
42.6
3lslD-3h6tA:
42.7		 3lslA-3h6tA:
99.61
3lslD-3h6tA:
99.61
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.
3hkz DNA-DIRECTED RNA
POLYMERASE SUBUNIT
A'
DNA-DIRECTED RNA
POLYMERASE, SUBUNIT
G (RPOG)

(Sulfolobus
solfataricus;
Sulfolobus
solfataricus) 		PF00623
(RNA_pol_Rpb1_2)
PF04983
(RNA_pol_Rpb1_3)
PF04997
(RNA_pol_Rpb1_1)
PF04998
(RNA_pol_Rpb1_5)
PF05000
(RNA_pol_Rpb1_4)
PF16992
(RNA_pol_RpbG) 		4 SER G  85
ASN G  88
ILE A 539
GLY G  73
 None
 0.69A 3lslA-3hkzG:
undetectable
3lslD-3hkzG:
undetectable		 3lslA-3hkzG:
17.92
3lslD-3hkzG:
17.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ik2 ENDOGLUCANASE A

(Clostridium
acetobutylicum) 		PF12891
(Glyco_hydro_44) 		4 ASN A  24
ILE A  37
SER A 176
SER A 351
 None
 0.92A 3lslA-3ik2A:
undetectable
3lslD-3ik2A:
undetectable		 3lslA-3ik2A:
18.55
3lslD-3ik2A:
18.55
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.
3j9o INTRACELLULAR GROWTH
LOCUS PROTEIN B

(Francisella
tularensis) 		PF05943
(VipB) 		4 PRO B 195
ILE B 197
SER B 374
GLY B 244
 None
 0.79A 3lslA-3j9oB:
undetectable
3lslD-3j9oB:
undetectable		 3lslA-3j9oB:
18.44
3lslD-3j9oB:
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.
3js3 3-DEHYDROQUINATE
DEHYDRATASE

(Clostridioides
difficile) 		PF01487
(DHquinase_I) 		4 PRO A  17
SER A 222
SER A 213
GLY A 217
 None
 0.93A 3lslA-3js3A:
undetectable
3lslD-3js3A:
undetectable		 3lslA-3js3A:
22.92
3lslD-3js3A:
22.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3k6h NITROREDUCTASE
FAMILY PROTEIN

(Agrobacterium
fabrum) 		PF00881
(Nitroreductase) 		5 ASN A 133
ILE A 170
PRO A  29
SER A 172
GLY A 171
 None
 1.32A 3lslA-3k6hA:
undetectable
3lslD-3k6hA:
undetectable		 3lslA-3k6hA:
21.29
3lslD-3k6hA:
21.29
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.
3kvn ESTERASE ESTA

(Pseudomonas
aeruginosa) 		no annotation 4 ASN X 147
ILE X  98
SER X  14
GLY X  12
 C8E  X 623 (-3.1A)
None
C8E  X 623 (-2.9A)
None
 0.95A 3lslA-3kvnX:
undetectable
3lslD-3kvnX:
undetectable		 3lslA-3kvnX:
16.61
3lslD-3kvnX:
16.61
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.
3kvn ESTERASE ESTA

(Pseudomonas
aeruginosa) 		no annotation 4 ASN X 147
ILE X  98
SER X  16
GLY X  12
 C8E  X 623 (-3.1A)
None
None
None
 0.88A 3lslA-3kvnX:
undetectable
3lslD-3kvnX:
undetectable		 3lslA-3kvnX:
16.61
3lslD-3kvnX:
16.61
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.
3lq1 2-SUCCINYL-5-ENOLPYR
UVYL-6-HYDROXY-3-CYC
LOHEXENE-1-CARBOXYLA
TE SYNTHASE

(Listeria
monocytogenes) 		PF02775
(TPP_enzyme_C)
PF02776
(TPP_enzyme_N)
PF16582
(TPP_enzyme_M_2) 		4 SER A 408
ASN A 486
ILE A 483
SER A 461
 None
 0.93A 3lslA-3lq1A:
1.0
3lslD-3lq1A:
undetectable		 3lslA-3lq1A:
19.48
3lslD-3lq1A:
19.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3mdq EXOPOLYPHOSPHATASE

(Cytophaga
hutchinsonii) 		PF02541
(Ppx-GppA) 		4 ASN A 150
ILE A 152
SER A 132
GLY A 147
 None
 0.88A 3lslA-3mdqA:
undetectable
3lslD-3mdqA:
undetectable		 3lslA-3mdqA:
22.19
3lslD-3mdqA:
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.
3ml6 CHIMERIC COMPLEX
BETWEEN PROTEIN
DISHEVLLED2 HOMOLOG
DVL-2 AND CLATHRIN
ADAPTOR AP-2 COMPLEX
SUBUNIT MU

(Mus musculus;
Rattus
norvegicus) 		PF00610
(DEP)
PF00928
(Adap_comp_sub) 		4 PRO A1267
SER A1204
PRO A1210
GLY A1208
 None
 0.93A 3lslA-3ml6A:
undetectable
3lslD-3ml6A:
undetectable		 3lslA-3ml6A:
22.92
3lslD-3ml6A:
22.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3nea PEPTIDYL-TRNA
HYDROLASE

(Francisella
tularensis) 		PF01195
(Pept_tRNA_hydro) 		4 PRO A  65
ASN A  12
SER A 120
GLY A 117
 None
 0.85A 3lslA-3neaA:
undetectable
3lslD-3neaA:
undetectable		 3lslA-3neaA:
21.03
3lslD-3neaA:
21.03
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.
3nuz PUTATIVE ACETYL
XYLAN ESTERASE

(Bacteroides
fragilis) 		PF12715
(Abhydrolase_7) 		4 ILE A 143
PRO A 261
SER A 146
GLY A 258
 None
 0.88A 3lslA-3nuzA:
undetectable
3lslD-3nuzA:
undetectable		 3lslA-3nuzA:
23.28
3lslD-3nuzA:
23.28
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.
3odg XANTHOSINE
PHOSPHORYLASE

(Yersinia
pseudotuberculosis) 		PF01048
(PNP_UDP_1) 		4 PRO A 108
ILE A 104
PRO A  66
GLY A  94
 None
 0.94A 3lslA-3odgA:
undetectable
3lslD-3odgA:
undetectable		 3lslA-3odgA:
22.50
3lslD-3odgA:
22.50
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.
3pdk PHOSPHOGLUCOSAMINE
MUTASE

(Bacillus
anthracis) 		PF00408
(PGM_PMM_IV)
PF02878
(PGM_PMM_I)
PF02879
(PGM_PMM_II)
PF02880
(PGM_PMM_III) 		4 SER A 286
ILE A 330
SER A 282
GLY A 324
 None
 0.93A 3lslA-3pdkA:
2.6
3lslD-3pdkA:
3.0		 3lslA-3pdkA:
20.34
3lslD-3pdkA:
20.34
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3qxm GLUTAMATE RECEPTOR
IONOTROPIC, KAINATE
2

(Homo sapiens) 		PF10613
(Lig_chan-Glu_bd) 		4 ILE A 488
PRO A 501
SER A 730
GLY A 732
 None
 0.28A 3lslA-3qxmA:
13.3
3lslD-3qxmA:
37.1		 3lslA-3qxmA:
51.92
3lslD-3qxmA:
51.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3rg9 BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE

(Trypanosoma
brucei) 		PF00186
(DHFR_1) 		4 PRO A  92
ILE A 118
PRO A 119
GLY A 117
 None
 0.90A 3lslA-3rg9A:
undetectable
3lslD-3rg9A:
undetectable		 3lslA-3rg9A:
23.64
3lslD-3rg9A:
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.
3rjl 1-PYRROLINE-5-CARBOX
YLATE DEHYDROGENASE

(Bacillus
licheniformis) 		PF00171
(Aldedh) 		4 PRO A 421
ILE A 376
SER A 387
GLY A 389
 None
 0.91A 3lslA-3rjlA:
undetectable
3lslD-3rjlA:
undetectable		 3lslA-3rjlA:
20.00
3lslD-3rjlA:
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.
3sbq NITROUS-OXIDE
REDUCTASE

(Pseudomonas
stutzeri) 		no annotation 4 SER A 332
ASN A 390
ILE A 476
GLY A 446
 None
 0.96A 3lslA-3sbqA:
undetectable
3lslD-3sbqA:
undetectable		 3lslA-3sbqA:
19.71
3lslD-3sbqA:
19.71
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3u92 GLUTAMATE RECEPTOR,
IONOTROPIC KAINATE 3

(Rattus
norvegicus) 		PF10613
(Lig_chan-Glu_bd) 		4 ILE A  91
PRO A 104
SER A 212
GLY A 214
 None
 0.26A 3lslA-3u92A:
37.0
3lslD-3u92A:
36.7		 3lslA-3u92A:
51.34
3lslD-3u92A:
51.34
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.
3ukf UDP-GALACTOPYRANOSE
MUTASE

(Aspergillus
fumigatus) 		PF13450
(NAD_binding_8) 		4 PRO A  17
ILE A 221
SER A  48
GLY A 219
 FDA  A 600 (-3.8A)
None
None
None
 0.90A 3lslA-3ukfA:
undetectable
3lslD-3ukfA:
undetectable		 3lslA-3ukfA:
19.14
3lslD-3ukfA:
19.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3umt SCFV HEAVY CHAIN AND
LIGHT CHAIN

(Mus musculus) 		PF07686
(V-set) 		4 SER A 231
ILE A  50
SER A  61
GLY A  51
 NHE  A 300 ( 4.4A)
None
NHE  A 300 (-4.6A)
None
 0.85A 3lslA-3umtA:
undetectable
3lslD-3umtA:
undetectable		 3lslA-3umtA:
21.03
3lslD-3umtA:
21.03
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.
3v5r PROTEIN GAL3

(Saccharomyces
cerevisiae) 		PF00288
(GHMP_kinases_N)
PF08544
(GHMP_kinases_C)
PF10509
(GalKase_gal_bdg) 		4 PRO A 144
ASN A 178
PRO A  83
GLY A 147
 None
 0.95A 3lslA-3v5rA:
undetectable
3lslD-3v5rA:
undetectable		 3lslA-3v5rA:
20.72
3lslD-3v5rA:
20.72
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.
3vml 3-ISOPROPYLMALATE
DEHYDROGENASE

(Shewanella
benthica;
Shewanella
oneidensis) 		PF00180
(Iso_dh) 		4 SER A 284
ILE A  48
PRO A  88
GLY A  44
 None
 0.96A 3lslA-3vmlA:
2.9
3lslD-3vmlA:
2.8		 3lslA-3vmlA:
22.60
3lslD-3vmlA:
22.60
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.
3voc BETA/ALPHA-AMYLASE

(Paenibacillus
polymyxa) 		PF01373
(Glyco_hydro_14) 		4 ILE A  93
SER A  49
SER A  97
GLY A  45
 None
 0.93A 3lslA-3vocA:
undetectable
3lslD-3vocA:
undetectable		 3lslA-3vocA:
22.68
3lslD-3vocA:
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.
3vth HYDROGENASE
MATURATION FACTOR

(Caldanaerobacter
subterraneus) 		PF00708
(Acylphosphatase)
PF01300
(Sua5_yciO_yrdC)
PF07503
(zf-HYPF) 		4 PRO A 391
ILE A  19
PRO A 106
GLY A  18
 None
 0.75A 3lslA-3vthA:
undetectable
3lslD-3vthA:
undetectable		 3lslA-3vthA:
19.58
3lslD-3vthA:
19.58
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.
3wwx S12 FAMILY PEPTIDASE

(Streptomyces
sp. 82F2) 		PF00144
(Beta-lactamase) 		4 SER A 367
ASN A 358
ILE A  87
GLY A 336
 None
 0.82A 3lslA-3wwxA:
undetectable
3lslD-3wwxA:
undetectable		 3lslA-3wwxA:
21.47
3lslD-3wwxA:
21.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3wwx S12 FAMILY PEPTIDASE

(Streptomyces
sp. 82F2) 		PF00144
(Beta-lactamase) 		4 SER A 367
ASN A 358
ILE A  87
SER A 342
 None
None
None
DIA  A 401 ( 3.4A)
 0.87A 3lslA-3wwxA:
undetectable
3lslD-3wwxA:
undetectable		 3lslA-3wwxA:
21.47
3lslD-3wwxA:
21.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3wxm PROTEIN PELOTA
HOMOLOG

(Aeropyrum
pernix) 		PF03463
(eRF1_1)
PF03465
(eRF1_3) 		4 ILE B  79
SER B  95
SER B  64
GLY B  78
 None
 0.89A 3lslA-3wxmB:
undetectable
3lslD-3wxmB:
undetectable		 3lslA-3wxmB:
22.25
3lslD-3wxmB:
22.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3zdr ALCOHOL
DEHYDROGENASE DOMAIN
OF THE BIFUNCTIONAL
ACETALDEHYDE
DEHYDROGENASE

(Parageobacillus
thermoglucosidasius) 		PF00465
(Fe-ADH) 		4 PRO A 853
ASN A 759
ILE A 861
SER A 731
 None
None
None
CSO  A 845 ( 2.5A)
 0.90A 3lslA-3zdrA:
undetectable
3lslD-3zdrA:
undetectable		 3lslA-3zdrA:
20.40
3lslD-3zdrA:
20.40
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.
3zl8 UDP-N-ACETYLMURAMOYL
-TRIPEPTIDE--D-ALANY
L-D-ALANINE LIGASE

(Thermotoga
maritima) 		PF01225
(Mur_ligase)
PF02875
(Mur_ligase_C)
PF08245
(Mur_ligase_M) 		4 SER A 312
ILE A 180
SER A  91
GLY A 167
 None
None
ADP  A1441 (-4.0A)
None
 0.94A 3lslA-3zl8A:
undetectable
3lslD-3zl8A:
undetectable		 3lslA-3zl8A:
21.90
3lslD-3zl8A:
21.90
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.
4boo ACETYLCHOLINE
RECEPTOR SUBUNIT
ALPHA
ACETYLCHOLINE
RECEPTOR BETA
SUBUNIT
ACETYLCHOLINE
RECEPTOR DELTA
SUBUNIT

(Torpedo
marmorata;
Torpedo
marmorata;
Torpedo
marmorata) 		PF02931
(Neur_chan_LBD)
PF02932
(Neur_chan_memb)
PF02931
(Neur_chan_LBD)
PF02932
(Neur_chan_memb)
PF02931
(Neur_chan_LBD)
PF02932
(Neur_chan_memb) 		4 SER C 258
ILE A 247
SER B 250
SER B 254
 None
 0.91A 3lslA-4booC:
undetectable
3lslD-4booC:
undetectable		 3lslA-4booC:
19.55
3lslD-4booC:
19.55
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.
4c3h DNA-DIRECTED RNA
POLYMERASE I SUBUNIT
RPA43

(Saccharomyces
cerevisiae) 		PF03876
(SHS2_Rpb7-N) 		4 PRO G  51
ILE G 107
PRO G 112
SER G  48
 None
 0.91A 3lslA-4c3hG:
undetectable
3lslD-4c3hG:
undetectable		 3lslA-4c3hG:
19.46
3lslD-4c3hG:
19.46
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.
4cgn GLYCYLPEPTIDE
N-TETRADECANOYLTRANS
FERASE

(Leishmania
major) 		PF01233
(NMT)
PF02799
(NMT_C) 		5 SER A 221
ILE A 235
PRO A 236
SER A 233
GLY A 234
 None
 1.35A 3lslA-4cgnA:
undetectable
3lslD-4cgnA:
undetectable		 3lslA-4cgnA:
20.40
3lslD-4cgnA:
20.40
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.
4efi 3-OXOACYL-(ACYL-CARR
IER PROTEIN)
SYNTHASE

(Paraburkholderia
xenovorans) 		PF08541
(ACP_syn_III_C)
PF08545
(ACP_syn_III) 		4 SER A 171
ASN A 276
ILE A 241
GLY A 238
 None
 0.82A 3lslA-4efiA:
undetectable
3lslD-4efiA:
undetectable		 3lslA-4efiA:
22.46
3lslD-4efiA:
22.46
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.
4ft6 PROBABLE PORIN

(Pseudomonas
aeruginosa) 		PF03573
(OprD) 		4 PRO A 282
SER A 210
SER A 225
GLY A 227
 None
 0.70A 3lslA-4ft6A:
undetectable
3lslD-4ft6A:
undetectable		 3lslA-4ft6A:
19.20
3lslD-4ft6A:
19.20
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.
4gq2 NUCLEOPORIN NUP120

(Schizosaccharomyces
pombe) 		PF11715
(Nup160) 		4 ILE M 576
SER M 569
SER M 651
GLY M 573
 None
 0.91A 3lslA-4gq2M:
undetectable
3lslD-4gq2M:
undetectable		 3lslA-4gq2M:
14.81
3lslD-4gq2M:
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.
4j1y COMPLEMENT C1S
SUBCOMPONENT

(Homo sapiens) 		PF00084
(Sushi)
PF00089
(Trypsin) 		5 PRO A 373
SER A 380
ILE A 361
PRO A 362
GLY A 360
 None
 1.31A 3lslA-4j1yA:
undetectable
3lslD-4j1yA:
undetectable		 3lslA-4j1yA:
22.42
3lslD-4j1yA:
22.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4jej GERANYLGERANYLGLYCER
YL PHOSPHATE
SYNTHASE

(Flavobacterium
johnsoniae) 		PF01884
(PcrB) 		4 ILE A 177
SER A 101
SER A 131
GLY A 133
 None
 0.87A 3lslA-4jejA:
undetectable
3lslD-4jejA:
undetectable		 3lslA-4jejA:
23.33
3lslD-4jejA:
23.33
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.
4k05 CONSERVED
HYPOTHETICAL
EXPORTED PROTEIN

(Bacteroides
fragilis) 		PF07075
(DUF1343) 		4 SER A 254
ILE A 180
PRO A 179
GLY A 147
 None
 0.91A 3lslA-4k05A:
undetectable
3lslD-4k05A:
undetectable		 3lslA-4k05A:
21.38
3lslD-4k05A:
21.38
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.
4kcd GLUTAMATE RECEPTOR
IONOTROPIC, NMDA 3A

(Rattus
norvegicus) 		PF10613
(Lig_chan-Glu_bd) 		4 ILE A 126
PRO A 139
SER A 142
GLY A 251
 None
 0.53A 3lslA-4kcdA:
29.7
3lslD-4kcdA:
29.7		 3lslA-4kcdA:
28.81
3lslD-4kcdA:
28.81
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.
4kjr CATION EXCHANGER
YFKE

(Bacillus
subtilis) 		PF01699
(Na_Ca_ex) 		4 SER A  76
ILE A 242
SER A  91
GLY A 243
 None
 0.78A 3lslA-4kjrA:
undetectable
3lslD-4kjrA:
undetectable		 3lslA-4kjrA:
21.23
3lslD-4kjrA:
21.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4lds BICYCLOMYCIN
RESISTANCE PROTEIN
TCAB

(Staphylococcus
epidermidis) 		PF00083
(Sugar_tr) 		5 SER A 262
ASN A 256
ILE A 144
SER A  27
GLY A  24
 None
 1.45A 3lslA-4ldsA:
undetectable
3lslD-4ldsA:
undetectable		 3lslA-4ldsA:
20.36
3lslD-4ldsA:
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.
4lr2 BIS(5'-ADENOSYL)-TRI
PHOSPHATASE ENPP4

(Homo sapiens) 		PF01663
(Phosphodiest) 		4 PRO A  47
ASN A  51
ILE A 214
GLY A 215
 None
 0.93A 3lslA-4lr2A:
undetectable
3lslD-4lr2A:
undetectable		 3lslA-4lr2A:
20.83
3lslD-4lr2A:
20.83
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.
4n5c CARGO-TRANSPORT
PROTEIN YPP1

(Saccharomyces
cerevisiae) 		no annotation 4 ASN A 150
ILE A 106
SER A 117
GLY A 105
 None
 0.92A 3lslA-4n5cA:
undetectable
3lslD-4n5cA:
undetectable		 3lslA-4n5cA:
14.57
3lslD-4n5cA:
14.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4o5m ISOVALERYL-COA
DEHYDROGENASE

(Brucella suis) 		PF00441
(Acyl-CoA_dh_1)
PF02770
(Acyl-CoA_dh_M)
PF02771
(Acyl-CoA_dh_N) 		4 SER A  91
ASN A 159
ILE A  83
GLY A  84
 None
 0.95A 3lslA-4o5mA:
undetectable
3lslD-4o5mA:
undetectable		 3lslA-4o5mA:
21.07
3lslD-4o5mA:
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.
4o8m TRAP DICARBOXYLATE
TRANSPORTER, DCTP
SUBUNIT

(Actinobacillus
succinogenes) 		PF03480
(DctP) 		4 ASN A 106
PRO A 211
SER A 237
GLY A 148
 None
None
2Q2  A 403 (-2.6A)
None
 0.92A 3lslA-4o8mA:
8.9
3lslD-4o8mA:
8.6		 3lslA-4o8mA:
19.88
3lslD-4o8mA:
19.88
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.
4oj5 TAILSPIKE PROTEIN

(Escherichia
virus CBA120) 		no annotation 5 ASN A 531
ILE A 496
SER A 471
SER A 499
GLY A 466
 None
 1.36A 3lslA-4oj5A:
undetectable
3lslD-4oj5A:
undetectable		 3lslA-4oj5A:
16.10
3lslD-4oj5A:
16.10
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.
4q2c CRISPR-ASSOCIATED
HELICASE CAS3

(Thermobaculum
terrenum) 		PF00271
(Helicase_C) 		4 PRO A 541
ILE A 759
PRO A 328
SER A 562
 None
 0.86A 3lslA-4q2cA:
undetectable
3lslD-4q2cA:
undetectable		 3lslA-4q2cA:
12.76
3lslD-4q2cA:
12.76
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.
4qt4 PEPTIDYL-TRNA
HYDROLASE

(Streptococcus
pyogenes) 		PF01195
(Pept_tRNA_hydro) 		4 PRO A  63
ASN A  10
SER A 118
GLY A 115
 None
 0.91A 3lslA-4qt4A:
undetectable
3lslD-4qt4A:
undetectable		 3lslA-4qt4A:
22.54
3lslD-4qt4A:
22.54
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4upe NICKEL-DEPENDENT
HYDROGENASE LARGE
SUBUNIT

(Desulfovibrio
fructosivorans) 		PF00374
(NiFeSe_Hases) 		4 PRO Q 542
ILE Q  21
SER Q  44
SER Q  46
 None
 0.86A 3lslA-4upeQ:
undetectable
3lslD-4upeQ:
undetectable		 3lslA-4upeQ:
19.01
3lslD-4upeQ:
19.01
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.
4yly PEPTIDYL-TRNA
HYDROLASE

(Staphylococcus
aureus) 		PF01195
(Pept_tRNA_hydro) 		4 PRO A  61
ASN A   9
SER A 116
GLY A 113
 None
 0.81A 3lslA-4ylyA:
undetectable
3lslD-4ylyA:
undetectable		 3lslA-4ylyA:
22.48
3lslD-4ylyA:
22.48