SIMILAR PATTERNS OF AMINO ACIDS FOR 3TBG_C_RTZC1

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.
1bqc PROTEIN
(BETA-MANNANASE)

(Thermobifida
fusca) 		PF00150
(Cellulase) 		5 PHE A 301
GLY A   3
LEU A   4
GLU A  13
PHE A  19
 None
 1.36A 3tbgC-1bqcA:
undetectable		 3tbgC-1bqcA:
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.
1f4h BETA-GALACTOSIDASE

(Escherichia
coli) 		PF00703
(Glyco_hydro_2)
PF02836
(Glyco_hydro_2_C)
PF02837
(Glyco_hydro_2_N)
PF02929
(Bgal_small_N)
PF16353
(DUF4981) 		5 LEU A 937
LEU A 910
GLY A 988
GLN A 956
PHE A 955
 None
 1.23A 3tbgC-1f4hA:
0.0		 3tbgC-1f4hA:
19.29
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.
1fdj FRUCTOSE
1,6-BISPHOSPHATE
ALDOLASE

(Oryctolagus
cuniculus) 		PF00274
(Glycolytic) 		5 LEU A1062
PHE A1063
GLY A1302
GLU A1034
GLN A1306
 None
None
2FP  A5001 (-3.6A)
None
None
 1.35A 3tbgC-1fdjA:
0.0		 3tbgC-1fdjA:
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.
1iwa RIBULOSE-1,5-BISPHOS
PHATE
CARBOXYLASE/OXYGENAS
E LARGE SUBUNIT

(Galdieria
partita) 		PF00016
(RuBisCO_large)
PF02788
(RuBisCO_large_N) 		5 LEU A 145
PHE A 148
PHE A 108
LEU A 116
LEU A  37
 None
 1.32A 3tbgC-1iwaA:
0.0		 3tbgC-1iwaA:
20.58
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.
1krm ADENOSINE DEAMINASE

(Bos taurus) 		PF00962
(A_deaminase) 		5 LEU A  59
GLY A 267
GLU A 214
ASP A 293
SER A 262
 PRH  A 401 (-4.5A)
None
PRH  A 401 (-2.5A)
PRH  A 401 (-3.5A)
None
 1.30A 3tbgC-1krmA:
0.0		 3tbgC-1krmA:
21.97
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.
1lvw GLUCOSE-1-PHOSPHATE
THYMIDYLYLTRANSFERAS
E

(Methanothermobacter
thermautotrophicus) 		PF00483
(NTP_transferase) 		5 GLY A 107
LEU A   6
GLN A  24
ASP A  57
SER A  53
 TYD  A3001 (-4.1A)
TYD  A3001 (-3.5A)
TYD  A3001 (-3.5A)
None
None
 1.05A 3tbgC-1lvwA:
0.0		 3tbgC-1lvwA:
21.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1pvj PYROGENIC EXOTOXIN B

(Streptococcus
pyogenes) 		PF01640
(Peptidase_C10)
PF13734
(Inhibitor_I69) 		5 LEU A 369
LEU A 372
GLY A 333
GLN A 390
SER A 123
 None
 1.30A 3tbgC-1pvjA:
undetectable		 3tbgC-1pvjA:
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.
1qyi HYPOTHETICAL PROTEIN

(Staphylococcus
aureus) 		PF13242
(Hydrolase_like) 		5 LEU A 122
PHE A 104
LEU A  93
GLY A  37
PHE A  85
 None
 1.26A 3tbgC-1qyiA:
0.0		 3tbgC-1qyiA:
22.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1xf1 C5A PEPTIDASE

(Streptococcus
pyogenes) 		PF00082
(Peptidase_S8)
PF02225
(PA)
PF06280
(fn3_5)
PF13585
(CHU_C) 		5 LEU A 479
GLY A 708
LEU A 686
GLU A 687
PHE A 709
 CIT  A1101 (-3.7A)
ACT  A1107 ( 4.2A)
None
None
None
 1.20A 3tbgC-1xf1A:
0.0		 3tbgC-1xf1A:
18.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ybe NICOTINATE
PHOSPHORIBOSYLTRANSF
ERASE

(Agrobacterium
tumefaciens) 		PF04095
(NAPRTase) 		5 LEU A 196
GLY A 370
LEU A 373
PHE A 201
SER A 199
 None
 1.25A 3tbgC-1ybeA:
undetectable		 3tbgC-1ybeA:
24.15
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1yr2 PROLYL
OLIGOPEPTIDASE

(Novosphingobium
capsulatum) 		PF00326
(Peptidase_S9)
PF02897
(Peptidase_S9_N) 		5 LEU A 713
PHE A 592
LEU A 569
GLY A 573
LEU A 580
 None
 1.02A 3tbgC-1yr2A:
undetectable		 3tbgC-1yr2A:
23.38
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.
1zel HYPOTHETICAL PROTEIN
RV2827C

(Mycobacterium
tuberculosis) 		PF09407
(AbiEi_1)
PF13338
(AbiEi_4) 		5 LEU A 289
PHE A 261
LEU A 284
GLY A 238
ASP A 282
 None
 1.16A 3tbgC-1zelA:
undetectable		 3tbgC-1zelA:
21.78
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.
2adf 82D6A3 IGG

(Mus musculus) 		PF07654
(C1-set)
PF07686
(V-set) 		5 PHE L  62
GLY L  16
LEU L  78
GLU L  79
SER L  76
 None
 1.28A 3tbgC-2adfL:
undetectable		 3tbgC-2adfL:
16.99
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.
2d7d UVRABC SYSTEM
PROTEIN B

(Bacillus
subtilis) 		PF00271
(Helicase_C)
PF02151
(UVR)
PF04851
(ResIII)
PF12344
(UvrB) 		5 LEU A 528
PHE A 527
GLY A 501
LEU A 475
SER A 477
 None
 1.18A 3tbgC-2d7dA:
undetectable		 3tbgC-2d7dA:
22.71
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.
2dh3 4F2 CELL-SURFACE
ANTIGEN HEAVY CHAIN

(Homo sapiens) 		PF00128
(Alpha-amylase) 		5 LEU A 488
PHE A 525
LEU A 523
GLY A 476
SER A 451
 None
 1.24A 3tbgC-2dh3A:
undetectable		 3tbgC-2dh3A:
22.58
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2f9q CYTOCHROME P450 2D6

(Homo sapiens) 		PF00067
(p450) 		8 LEU A 110
PHE A 112
PHE A 120
LEU A 121
GLY A 212
GLN A 244
ASP A 301
SER A 304
 None
None
HEM  A 600 (-4.6A)
None
None
None
None
None
 1.18A 3tbgC-2f9qA:
54.4		 3tbgC-2f9qA:
99.37
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2f9q CYTOCHROME P450 2D6

(Homo sapiens) 		PF00067
(p450) 		8 LEU A 110
PHE A 112
PHE A 120
LEU A 121
GLY A 212
PHE A 247
ASP A 301
SER A 304
 None
None
HEM  A 600 (-4.6A)
None
None
None
None
None
 0.81A 3tbgC-2f9qA:
54.4		 3tbgC-2f9qA:
99.37
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2f9q CYTOCHROME P450 2D6

(Homo sapiens) 		PF00067
(p450) 		5 LEU A 248
GLY A 212
GLN A 244
ASP A 301
SER A 304
 None
 1.31A 3tbgC-2f9qA:
54.4		 3tbgC-2f9qA:
99.37
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2f9q CYTOCHROME P450 2D6

(Homo sapiens) 		PF00067
(p450) 		5 LEU A 248
GLY A 212
LEU A 213
GLU A 216
GLN A 244
 None
 1.35A 3tbgC-2f9qA:
54.4		 3tbgC-2f9qA:
99.37
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2f9q CYTOCHROME P450 2D6

(Homo sapiens) 		PF00067
(p450) 		5 PHE A 120
LEU A 121
GLY A 212
GLU A 216
GLN A 244
 HEM  A 600 (-4.6A)
None
None
None
None
 1.18A 3tbgC-2f9qA:
54.4		 3tbgC-2f9qA:
99.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ge3 PROBABLE
ACETYLTRANSFERASE

(Agrobacterium
tumefaciens) 		PF00583
(Acetyltransf_1) 		5 LEU A 111
PHE A 168
PHE A 117
LEU A 119
PHE A  61
 None
 1.18A 3tbgC-2ge3A:
undetectable		 3tbgC-2ge3A:
16.15
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2jg2 SERINE
PALMITOYLTRANSFERASE

(Sphingomonas
paucimobilis) 		PF00155
(Aminotran_1_2) 		5 LEU A 229
LEU A 154
GLY A 140
LEU A 139
SER A 161
 None
None
None
None
PLP  A1265 (-3.3A)
 1.30A 3tbgC-2jg2A:
undetectable		 3tbgC-2jg2A:
22.02
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.
2ld7 HISTONE DEACETYLASE
COMPLEX SUBUNIT
SAP30
PAIRED AMPHIPATHIC
HELIX PROTEIN SIN3A

(Mus musculus) 		PF02671
(PAH)
PF13867
(SAP30_Sin3_bdg) 		5 PHE B 516
PHE B 508
LEU A 150
GLN A 152
PHE A 186
 None
 1.30A 3tbgC-2ld7B:
undetectable		 3tbgC-2ld7B:
10.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2nsm CARBOXYPEPTIDASE N
CATALYTIC CHAIN

(Homo sapiens) 		PF00246
(Peptidase_M14)
PF13620
(CarboxypepD_reg) 		5 PHE A 314
PHE A 283
GLY A 321
LEU A 360
GLN A 320
 None
 1.24A 3tbgC-2nsmA:
undetectable		 3tbgC-2nsmA:
22.07
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.
2r98 PUTATIVE
ACETYLGLUTAMATE
SYNTHASE

(Neisseria
gonorrhoeae) 		PF00583
(Acetyltransf_1)
PF00696
(AA_kinase) 		5 LEU A  59
LEU A  26
LEU A  49
SER A  51
PHE A 272
 None
 1.34A 3tbgC-2r98A:
undetectable		 3tbgC-2r98A:
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.
2uvf EXOPOLYGALACTURONASE

(Yersinia
enterocolitica) 		PF00295
(Glyco_hydro_28)
PF12708
(Pectate_lyase_3) 		5 LEU A 460
GLY A 287
LEU A 286
GLU A 285
ASP A 399
 None
 1.27A 3tbgC-2uvfA:
undetectable		 3tbgC-2uvfA:
19.22
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.
2vn7 GLUCOAMYLASE

(Trichoderma
reesei) 		PF00686
(CBM_20)
PF00723
(Glyco_hydro_15) 		5 LEU A 358
PHE A 354
LEU A 282
GLY A 387
LEU A 389
 None
 1.34A 3tbgC-2vn7A:
undetectable		 3tbgC-2vn7A:
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.
2xbl PHOSPHOHEPTOSE
ISOMERASE

(Burkholderia
pseudomallei) 		PF13580
(SIS_2) 		5 LEU A 179
GLY A  67
GLU A  68
ASP A  61
PHE A  73
 None
None
ZN  A1197 ( 2.2A)
None
None
 1.22A 3tbgC-2xblA:
2.5		 3tbgC-2xblA:
18.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2yut PUTATIVE SHORT-CHAIN
OXIDOREDUCTASE

(Thermus
thermophilus) 		PF00106
(adh_short) 		5 LEU A  25
LEU A  69
GLY A  14
LEU A  12
PHE A 119
 None
None
None
NAP  A 500 (-4.0A)
NAP  A 500 ( 4.4A)
 1.24A 3tbgC-2yutA:
undetectable		 3tbgC-2yutA:
21.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2zzg ALANYL-TRNA
SYNTHETASE

(Pyrococcus
horikoshii) 		PF01411
(tRNA-synt_2c)
PF07973
(tRNA_SAD) 		5 LEU A 645
PHE A 748
LEU A 638
GLY A 696
GLN A 633
 None
 1.19A 3tbgC-2zzgA:
1.7		 3tbgC-2zzgA:
21.34
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.
3a4t PUTATIVE
METHYLTRANSFERASE
MJ0026

(Methanocaldococcus
jannaschii) 		PF01189
(Methyltr_RsmB-F) 		5 LEU A  79
PHE A  86
GLY A 197
LEU A 200
ASP A 158
 None
 1.27A 3tbgC-3a4tA:
undetectable		 3tbgC-3a4tA:
16.70
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.
3aw5 MULTICOPPER OXIDASE

(Pyrobaculum
aerophilum) 		PF00394
(Cu-oxidase)
PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3) 		5 LEU A  85
LEU A  81
GLY A 146
LEU A 148
GLN A 147
 None
 1.32A 3tbgC-3aw5A:
undetectable		 3tbgC-3aw5A:
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.
3e7n D-RIBOSE
HIGH-AFFINITY
TRANSPORT SYSTEM

(Salmonella
enterica) 		PF05025
(RbsD_FucU) 		5 PHE A  51
LEU A  80
GLY A  30
LEU A  31
SER A 122
 None
None
EDO  A 300 (-4.1A)
EDO  A 300 (-4.3A)
None
 1.26A 3tbgC-3e7nA:
undetectable		 3tbgC-3e7nA:
14.88
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.
3gi8 UNCHARACTERIZED
PROTEIN MJ0609

(Methanocaldococcus
jannaschii) 		PF13520
(AA_permease_2) 		5 PHE C  27
GLY C 272
LEU C 275
PHE C 273
SER C 277
 None
 1.04A 3tbgC-3gi8C:
1.1		 3tbgC-3gi8C:
21.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3h09 IMMUNOGLOBULIN A1
PROTEASE

(Haemophilus
influenzae) 		PF02395
(Peptidase_S6)
PF03212
(Pertactin) 		5 LEU A 371
LEU A 399
GLY A 409
GLN A 405
PHE A 412
 None
 1.17A 3tbgC-3h09A:
undetectable		 3tbgC-3h09A:
18.59
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.
3hiq VACUOLAR SAPORIN

(Saponaria
officinalis) 		PF00161
(RIP) 		5 LEU A 186
PHE A  19
LEU A  20
GLY A 140
LEU A 144
 None
 1.13A 3tbgC-3hiqA:
undetectable		 3tbgC-3hiqA:
20.70
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.
3hiw VACUOLAR SAPORIN

(Saponaria
officinalis) 		PF00161
(RIP) 		5 LEU A 186
PHE A  19
LEU A  20
GLY A 140
LEU A 144
 None
 1.12A 3tbgC-3hiwA:
undetectable		 3tbgC-3hiwA:
18.63
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.
3hmj FATTY ACID SYNTHASE
SUBUNIT ALPHA

(Saccharomyces
cerevisiae) 		PF00109
(ketoacyl-synt)
PF01648
(ACPS)
PF02801
(Ketoacyl-synt_C) 		5 LEU A 638
PHE A 659
LEU A 908
GLY A 870
PHE A 771
 None
 1.31A 3tbgC-3hmjA:
2.5		 3tbgC-3hmjA:
13.03
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.
3il4 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
SYNTHASE 3

(Enterococcus
faecalis) 		PF08541
(ACP_syn_III_C)
PF08545
(ACP_syn_III) 		5 LEU A 238
PHE A 179
LEU A 323
GLY A 319
PHE A 120
 None
 1.29A 3tbgC-3il4A:
undetectable		 3tbgC-3il4A:
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.
3j09 COPPER-EXPORTING
P-TYPE ATPASE A

(Archaeoglobus
fulgidus) 		PF00122
(E1-E2_ATPase)
PF00403
(HMA)
PF00702
(Hydrolase) 		5 LEU A 372
PHE A 369
PHE A 118
GLY A 109
LEU A 111
 None
 1.17A 3tbgC-3j09A:
2.3		 3tbgC-3j09A:
21.62
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.
3k2g RESINIFERATOXIN-BIND
ING,
PHOSPHOTRIESTERASE-R
ELATED PROTEIN

(Rhodobacter
sphaeroides) 		PF02126
(PTE) 		5 LEU A 257
PHE A 324
LEU A 299
GLY A 287
LEU A 286
 None
 1.32A 3tbgC-3k2gA:
undetectable		 3tbgC-3k2gA:
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.
3keh GLUCOCEREBROSIDASE

(Homo sapiens) 		PF02055
(Glyco_hydro_30)
PF17189
(Glyco_hydro_30C) 		5 LEU A 354
PHE A   9
GLY A 389
GLU A 388
ASP A 405
 None
 1.35A 3tbgC-3kehA:
undetectable		 3tbgC-3kehA:
22.66
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.
3l2j FUSION PROTEIN OF
MALTOSE-BINDING
PERIPLASMIC PROTEIN
AND PARATHYROID
HORMONE/PARATHYROID
HORMONE-RELATED
PEPTIDE RECEPTOR

(Escherichia
coli;
Homo sapiens) 		PF02793
(HRM)
PF13416
(SBP_bac_8) 		5 PHE A-188
GLY A -44
LEU A -45
GLU A-233
ASP A-330
 MAL  A 194 (-4.4A)
None
None
MAL  A 194 (-2.9A)
MAL  A 194 (-2.9A)
 1.24A 3tbgC-3l2jA:
undetectable		 3tbgC-3l2jA:
21.18
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.
3lv8 THYMIDYLATE KINASE

(Vibrio cholerae) 		PF02223
(Thymidylate_kin) 		5 GLY A  10
LEU A  11
GLU A  12
SER A 102
PHE A 165
 None
None
TYD  A 215 (-2.8A)
TMP  A 214 ( 4.2A)
None
 1.29A 3tbgC-3lv8A:
undetectable		 3tbgC-3lv8A:
19.62
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.
3mc2 INHIBITOR OF
CARBONIC ANHYDRASE

(Mus musculus) 		PF00405
(Transferrin) 		5 LEU A 320
LEU A 326
GLY A  64
LEU A  66
SER A 125
 None
 1.35A 3tbgC-3mc2A:
undetectable		 3tbgC-3mc2A:
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.
3mmt FRUCTOSE-BISPHOSPHAT
E ALDOLASE

(Bartonella
henselae) 		PF00274
(Glycolytic) 		5 LEU A  52
PHE A  53
GLY A 294
GLU A  24
GLN A 298
 None
None
2FP  A 350 (-3.3A)
2FP  A 350 ( 4.9A)
None
 1.35A 3tbgC-3mmtA:
undetectable		 3tbgC-3mmtA:
24.12
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.
3oce FUMARATE LYASE:DELTA
CRYSTALLIN

(Brucella
abortus) 		PF00206
(Lyase_1)
PF10415
(FumaraseC_C) 		5 PHE A 276
LEU A 152
GLY A 376
LEU A 375
GLN A 158
 None
 1.30A 3tbgC-3oceA:
1.5		 3tbgC-3oceA:
22.80
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.
3olm E3 UBIQUITIN-PROTEIN
LIGASE RSP5

(Saccharomyces
cerevisiae) 		PF00397
(WW)
PF00632
(HECT) 		5 PHE A 512
PHE A 504
LEU A 507
GLY A 666
PHE A 667
 None
 1.26A 3tbgC-3olmA:
undetectable		 3tbgC-3olmA:
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.
3pdi NITROGENASE MOFE
COFACTOR
BIOSYNTHESIS PROTEIN
NIFN

(Azotobacter
vinelandii) 		PF00148
(Oxidored_nitro) 		5 LEU B 185
GLY B  30
LEU B  29
ASP B 210
PHE B  52
 None
 1.29A 3tbgC-3pdiB:
undetectable		 3tbgC-3pdiB:
23.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3q1o GERANYLTRANSTRANSFER
ASE (ISPA)

(Helicobacter
pylori) 		PF00348
(polyprenyl_synt) 		5 LEU A  89
PHE A  39
GLY A  46
GLU A  82
PHE A  16
 DMA  A 501 ( 4.8A)
None
DMA  A 500 (-3.4A)
DMA  A 500 ( 4.6A)
None
 1.27A 3tbgC-3q1oA:
undetectable		 3tbgC-3q1oA:
20.82
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.
3sh5 LG3 PEPTIDE

(Homo sapiens) 		PF00054
(Laminin_G_1) 		5 LEU A  46
PHE A  75
LEU A  66
GLY A  51
PHE A  23
 None
 1.13A 3tbgC-3sh5A:
undetectable		 3tbgC-3sh5A:
18.90
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.
3swd UDP-N-ACETYLGLUCOSAM
INE
1-CARBOXYVINYLTRANSF
ERASE

(Escherichia
coli) 		PF00275
(EPSP_synthase) 		5 LEU A 198
PHE A 197
GLY A  98
LEU A 100
PHE A 104
 None
 1.32A 3tbgC-3swdA:
undetectable		 3tbgC-3swdA:
21.39
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.
3vcy UDP-N-ACETYLGLUCOSAM
INE
1-CARBOXYVINYLTRANSF
ERASE

(Aliivibrio
fischeri) 		PF00275
(EPSP_synthase) 		5 LEU A 199
PHE A 198
GLY A  99
LEU A 101
PHE A 105
 None
 1.33A 3tbgC-3vcyA:
undetectable		 3tbgC-3vcyA:
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.
3vr0 PUTATIVE
UNCHARACTERIZED
PROTEIN

(Pyrococcus
furiosus) 		PF09754
(PAC2) 		5 LEU A  36
GLY A 121
LEU A 124
PHE A 117
PHE A  32
 None
 1.17A 3tbgC-3vr0A:
undetectable		 3tbgC-3vr0A:
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.
3vyw MNMC2

(Aquifex
aeolicus) 		PF05430
(Methyltransf_30) 		5 LEU A 203
GLY A 173
LEU A 172
GLU A 133
ASP A 102
 SAM  A 501 (-4.6A)
None
None
SAM  A 501 (-2.3A)
SAM  A 501 ( 4.9A)
 1.05A 3tbgC-3vywA:
undetectable		 3tbgC-3vywA:
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.
3w5f BETA-GALACTOSIDASE

(Solanum
lycopersicum) 		PF01301
(Glyco_hydro_35) 		5 LEU A 545
PHE A 123
GLY A 558
LEU A 560
GLU A 456
 None
 1.13A 3tbgC-3w5fA:
undetectable		 3tbgC-3w5fA:
20.67
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.
3wsu BETA-MANNANASE

(Streptomyces
thermolilacinus) 		PF00150
(Cellulase) 		5 PHE A 348
GLY A  64
LEU A  54
GLU A  63
PHE A  69
 None
 1.29A 3tbgC-3wsuA:
undetectable		 3tbgC-3wsuA:
20.57
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.
3wxo CATALASE-PEROXIDASE

(Synechococcus
elongatus) 		PF00141
(peroxidase) 		5 GLY A 616
LEU A 615
ASP A 468
SER A 464
PHE A 704
 None
 1.21A 3tbgC-3wxoA:
undetectable		 3tbgC-3wxoA:
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.
4c1n IRON-SULFUR CLUSTER
BINDING PROTEIN

(Carboxydothermus
hydrogenoformans) 		PF14574
(DUF4445) 		5 LEU I 575
LEU I 582
GLY I 232
LEU I 231
GLN I 221
 None
 1.29A 3tbgC-4c1nI:
undetectable		 3tbgC-4c1nI:
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.
4ca9 39 KDA FK506-BINDING
NUCLEAR PROTEIN

(Drosophila
melanogaster) 		no annotation 5 LEU A  65
GLY A  10
LEU A  11
SER A  86
PHE A  77
 None
 1.22A 3tbgC-4ca9A:
undetectable		 3tbgC-4ca9A:
12.33
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.
4e1e FARNESYL
PYROPHOSPHATE
SYNTHASE

(Trypanosoma
cruzi) 		PF00348
(polyprenyl_synt) 		5 LEU A  95
PHE A  89
GLY A  47
GLU A  88
PHE A   7
 None
None
IPE  A 405 (-3.6A)
None
None
 1.26A 3tbgC-4e1eA:
undetectable		 3tbgC-4e1eA:
22.24
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.
4fk9 CELLULOSE-BINDING
FAMILY II

(Streptomyces
sp. SirexAA-E) 		PF00150
(Cellulase) 		5 PHE A 348
GLY A  64
LEU A  54
GLU A  63
PHE A  69
 None
 1.28A 3tbgC-4fk9A:
undetectable		 3tbgC-4fk9A:
20.53
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.
4h43 27.5 KDA VIRULENCE
PROTEIN

(Salmonella
enterica) 		PF03536
(VRP3) 		5 PHE A 172
LEU A 173
GLY A 102
ASP A 162
PHE A 105
 None
 1.34A 3tbgC-4h43A:
undetectable		 3tbgC-4h43A:
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.
4hea NADH-QUINONE
OXIDOREDUCTASE
SUBUNIT 13

(Thermus
thermophilus) 		PF00361
(Proton_antipo_M) 		5 LEU M  67
LEU M  70
GLY M 108
LEU M 109
PHE M  65
 None
 1.27A 3tbgC-4heaM:
undetectable		 3tbgC-4heaM:
24.35
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.
4hgz CCBJ

(Streptomyces
caelestis) 		PF13649
(Methyltransf_25) 		5 LEU A 216
LEU A 151
GLY A 125
LEU A 124
GLN A 129
 None
None
SO4  A 302 (-3.0A)
None
None
 1.35A 3tbgC-4hgzA:
undetectable		 3tbgC-4hgzA:
21.85
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.
4irf MALARIAL CLPB2
ATPASE/HSP101
PROTEIN

(Plasmodium
falciparum) 		PF02861
(Clp_N) 		5 LEU A 145
PHE A  54
LEU A  53
GLY A 120
LEU A 121
 None
 1.30A 3tbgC-4irfA:
undetectable		 3tbgC-4irfA:
14.74
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.
4ls3 NICKEL (III) ABC
TRANSPORTER,
PERIPLASMIC
IRON-BINDIN GPROTEIN

(Helicobacter
pylori) 		PF01497
(Peripla_BP_2) 		5 LEU A 119
GLY A  43
GLN A  45
PHE A  42
SER A 142
 None
 1.32A 3tbgC-4ls3A:
undetectable		 3tbgC-4ls3A:
21.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ofw PROTEIN DJ-1 HOMOLOG
D

(Arabidopsis
thaliana) 		PF01965
(DJ-1_PfpI) 		5 PHE A 388
PHE A 185
LEU A 189
LEU A   8
PHE A 109
 None
 1.33A 3tbgC-4ofwA:
undetectable		 3tbgC-4ofwA:
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.
4op4 SUCCINYL-DIAMINOPIME
LATE DESUCCINYLASE

(Vibrio cholerae) 		PF01546
(Peptidase_M20) 		5 LEU A 106
LEU A  29
GLY A  98
ASP A  23
SER A  18
 None
 1.22A 3tbgC-4op4A:
undetectable		 3tbgC-4op4A:
19.75
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.
4pc9 C4-DICARBOXYLATE
TRANSPORT SYSTEM,
SUBSTRATE-BINDING
PROTEIN, PUTATIVE

(Roseobacter
denitrificans) 		PF03480
(DctP) 		5 LEU A 115
GLY A 271
LEU A 272
GLU A 269
SER A 276
 None
 1.13A 3tbgC-4pc9A:
undetectable		 3tbgC-4pc9A:
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.
4q1j POLYKETIDE
BIOSYNTHESIS
ENOYL-COA ISOMERASE
PKSI

(Bacillus
subtilis) 		PF00378
(ECH_1) 		5 LEU A 170
PHE A 177
LEU A 114
GLY A 163
PHE A 131
 None
None
None
EDO  A 303 ( 4.4A)
None
 1.20A 3tbgC-4q1jA:
undetectable		 3tbgC-4q1jA:
21.77
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.
4q8g PAB-DEPENDENT
POLY(A)-SPECIFIC
RIBONUCLEASE SUBUNIT
PAN2

(Saccharomyces
cerevisiae) 		PF13423
(UCH_1) 		5 PHE A 648
GLY A 551
LEU A 553
PHE A 530
PHE A 570
 None
 1.31A 3tbgC-4q8gA:
undetectable		 3tbgC-4q8gA:
21.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4r7u UDP-N-ACETYLGLUCOSAM
INE
1-CARBOXYVINYLTRANSF
ERASE

(Vibrio cholerae) 		PF00275
(EPSP_synthase) 		5 LEU A 199
PHE A 198
GLY A  99
LEU A 101
PHE A 105
 None
 1.35A 3tbgC-4r7uA:
undetectable		 3tbgC-4r7uA:
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.
4rk1 RIBOSE
TRANSCRIPTIONAL
REGULATOR

(Enterococcus
faecium) 		PF13377
(Peripla_BP_3) 		5 LEU A 250
PHE A 227
PHE A  80
GLY A 171
ASP A 279
 None
RIB  A 401 (-4.6A)
RIB  A 401 (-3.6A)
None
RIB  A 401 (-2.7A)
 1.29A 3tbgC-4rk1A:
undetectable		 3tbgC-4rk1A:
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.
4yg8 CHITIN BIOSYNTHESIS
PROTEIN CHS5
CHITIN BIOSYNTHESIS
PROTEIN CHS6

(Saccharomyces
cerevisiae) 		PF00533
(BRCT)
PF09295
(ChAPs)
PF16893
(fn3_2) 		5 LEU B 340
PHE B 346
LEU B 347
LEU A  71
GLN A  67
 None
 1.28A 3tbgC-4yg8B:
undetectable		 3tbgC-4yg8B:
20.32
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5a0z CHOLINE
TRIMETHYLAMINE LYASE

(Klebsiella
pneumoniae) 		PF01228
(Gly_radical)
PF02901
(PFL-like) 		5 LEU A 865
LEU A 608
GLY A 511
PHE A 508
SER A 601
 None
 1.31A 3tbgC-5a0zA:
2.5		 3tbgC-5a0zA:
20.25
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.
5ahu FARNESYL
PYROPHOSPHATE
SYNTHASE
FARNESYL
PYROPHOSPHATE
SYNTHASE, PUTATIVE

(Trypanosoma
brucei) 		PF00348
(polyprenyl_synt)
no annotation 		5 LEU B 100
PHE B  94
GLY A  46
GLU B  93
PHE A   6
 None
 1.22A 3tbgC-5ahuB:
1.4		 3tbgC-5ahuB:
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.
5cth BIDIRECTIONAL SUGAR
TRANSPORTER SWEET2B

(Oryza sativa) 		PF03083
(MtN3_slv) 		5 PHE A 134
GLY A 114
LEU A 117
PHE A 115
SER A 119
 None
 1.32A 3tbgC-5cthA:
undetectable		 3tbgC-5cthA:
19.07
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.
5dis MALTOSE-BINDING
PERIPLASMIC
PROTEIN,NUCLEAR PORE
COMPLEX PROTEIN
NUP214

(Escherichia
coli;
Homo sapiens) 		PF13416
(SBP_bac_8) 		5 PHE D 156
GLY D 300
LEU D 299
GLU D 111
ASP D  14
 None
 1.30A 3tbgC-5disD:
undetectable		 3tbgC-5disD:
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.
5gjv VOLTAGE-DEPENDENT
L-TYPE CALCIUM
CHANNEL SUBUNIT
ALPHA-1S

(Oryctolagus
cuniculus) 		PF00520
(Ion_trans)
PF08763
(Ca_chan_IQ)
PF16905
(GPHH) 		5 LEU A1020
LEU A 604
GLN A 602
PHE A 597
SER A 606
 None
PC1  A1914 ( 4.3A)
None
None
None
 1.34A 3tbgC-5gjvA:
2.6		 3tbgC-5gjvA:
13.82
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.
5i92 GLUTAMATE-1-SEMIALDE
HYDE 2,1-AMINOMUTASE

(Pseudomonas
aeruginosa) 		PF00202
(Aminotran_3) 		5 GLY A 353
LEU A 324
PHE A 355
ASP A  54
PHE A 320
 None
None
EDO  A 502 ( 4.6A)
None
None
 1.31A 3tbgC-5i92A:
2.0		 3tbgC-5i92A:
23.00
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.
5ikp GLYCOGEN
PHOSPHORYLASE, BRAIN
FORM

(Homo sapiens) 		PF00343
(Phosphorylase) 		5 LEU A 279
GLY A 137
LEU A 139
PHE A  89
SER A  86
 None
 1.23A 3tbgC-5ikpA:
undetectable		 3tbgC-5ikpA:
20.65
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.
5jzb 4,5:9,10-DISECO-3-HY
DROXY-5,9,17-TRIOXOA
NDROSTA-1(10),2-DIEN
E-4-OATE HYDROLASE

(Mycobacterium
tuberculosis) 		PF12697
(Abhydrolase_6) 		5 LEU A  62
PHE A  66
PHE A 286
GLY A 112
LEU A 136
 None
 1.34A 3tbgC-5jzbA:
undetectable		 3tbgC-5jzbA:
23.22
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.
5kin TRYPTOPHAN SYNTHASE
BETA CHAIN

(Streptococcus
pneumoniae) 		PF00291
(PALP) 		5 LEU B  79
GLY B 340
LEU B 343
PHE B 341
SER B 345
 None
 1.20A 3tbgC-5kinB:
undetectable		 3tbgC-5kinB:
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.
5kl0 PHOSPHOGLUCOMUTASE

(Xanthomonas
citri) 		PF00408
(PGM_PMM_IV)
PF02878
(PGM_PMM_I)
PF02879
(PGM_PMM_II)
PF02880
(PGM_PMM_III) 		5 LEU A 192
PHE A 216
LEU A 208
LEU A 364
PHE A 267
 None
 1.32A 3tbgC-5kl0A:
undetectable		 3tbgC-5kl0A:
23.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5kl0 PHOSPHOGLUCOMUTASE

(Xanthomonas
citri) 		PF00408
(PGM_PMM_IV)
PF02878
(PGM_PMM_I)
PF02879
(PGM_PMM_II)
PF02880
(PGM_PMM_III) 		5 LEU A 192
PHE A 216
LEU A 212
LEU A 364
PHE A 267
 None
 1.33A 3tbgC-5kl0A:
undetectable		 3tbgC-5kl0A:
23.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5lc5 NADH-UBIQUINONE
OXIDOREDUCTASE CHAIN
1
NADH-UBIQUINONE
OXIDOREDUCTASE CHAIN
3
NADH-UBIQUINONE
OXIDOREDUCTASE CHAIN
6

(Bos taurus) 		PF00146
(NADHdh)
PF00499
(Oxidored_q3)
PF00507
(Oxidored_q4) 		5 LEU H 298
GLY J 158
LEU J 161
GLU A  68
SER A 101
 None
 1.26A 3tbgC-5lc5H:
undetectable		 3tbgC-5lc5H:
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.
5nkm PROTEIN SMG-8

(Caenorhabditis
elegans) 		PF10220
(Smg8_Smg9) 		5 LEU E 295
LEU E  45
GLY E  26
LEU E  75
ASP E  70
 None
None
None
None
EDO  E 501 (-4.7A)
 1.28A 3tbgC-5nkmE:
undetectable		 3tbgC-5nkmE:
22.24
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.
5o27 NEUROGLOBIN

(Mus musculus) 		no annotation 5 LEU A  38
PHE A  42
GLY A 110
LEU A 113
PHE A 106
 HEM  A 201 ( 4.7A)
HEM  A 201 (-3.8A)
None
XE  A 206 ( 4.5A)
XE  A 211 (-4.3A)
 1.21A 3tbgC-5o27A:
undetectable		 3tbgC-5o27A:
14.82
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.
5vgj 1FD6-V1V2-WITO

(Human
immunodeficiency
virus 1) 		PF00516
(GP120)
PF01378
(IgG_binding_B) 		5 LEU G 193
GLY G 240
LEU G 241
GLU G 239
PHE G 159
 None
NAG  G1600 (-3.9A)
None
None
None
 1.34A 3tbgC-5vgjG:
undetectable		 3tbgC-5vgjG:
14.09
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.
5w19 TRYPTOPHANASE

(Proteus
vulgaris) 		no annotation 5 GLY A 315
LEU A 269
GLN A 314
ASP A  59
SER A  58
 None
 1.35A 3tbgC-5w19A:
undetectable		 3tbgC-5w19A:
10.66
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.
5w1k CR1-10 FAB HEAVY
CHAIN

(Homo sapiens) 		no annotation 5 LEU D  65
GLY D  46
LEU D  47
GLU D  48
ASP D  91
 None
 1.27A 3tbgC-5w1kD:
undetectable		 3tbgC-5w1kD:
11.23
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.
5w2l CST COMPLEX SUBUNIT
CTC1

(Homo sapiens) 		no annotation 5 LEU A 798
PHE A 800
LEU A 811
LEU A 732
PHE A 830
 None
 1.35A 3tbgC-5w2lA:
undetectable		 3tbgC-5w2lA:
16.42
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.
5xn7 PUTATIVE RTX-TOXIN

(Vibrio
vulnificus) 		PF11647
(MLD) 		5 LEU A2480
GLY A2433
GLU A2432
GLN A2483
ASP A2502
 None
 1.24A 3tbgC-5xn7A:
undetectable		 3tbgC-5xn7A:
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.
5xqo PCRGLX PROTEIN

(Penicillium
chrysogenum) 		no annotation 5 LEU A 789
PHE A 706
GLY A 750
LEU A 747
SER A 755
 None
 1.04A 3tbgC-5xqoA:
undetectable		 3tbgC-5xqoA:
9.19
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.
5ykb TREHALOSE SYNTHASE

(Deinococcus
radiodurans) 		no annotation 5 LEU A 483
PHE A 500
LEU A 283
GLY A 300
LEU A 302
 None
 1.27A 3tbgC-5ykbA:
undetectable		 3tbgC-5ykbA:
22.95
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.
6bb4 MOUSE MONOCLONAL
ANTIBODY C5.2 FAB
LIGHT CHAIN

(Mus musculus) 		no annotation 5 PHE L  62
GLY L  16
LEU L  78
GLU L  79
SER L  76
 None
 1.35A 3tbgC-6bb4L:
undetectable		 3tbgC-6bb4L:
12.68
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.
6byo VOLTAGE-DEPENDENT
L-TYPE CALCIUM
CHANNEL SUBUNIT
ALPHA-1S

(Oryctolagus
cuniculus) 		no annotation 5 LEU A1020
LEU A 604
GLN A 602
PHE A 597
SER A 606
 None
 1.35A 3tbgC-6byoA:
1.8		 3tbgC-6byoA:
11.20
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.
6c96 TWO PORE CALCIUM
CHANNEL PROTEIN 1

(Mus musculus) 		no annotation 5 LEU A 277
PHE A 283
GLY A 251
LEU A 254
SER A 290
 None
 1.30A 3tbgC-6c96A:
undetectable		 3tbgC-6c96A:
10.68
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.
6ftl RIBULOSE
BISPHOSPHATE
CARBOXYLASE LARGE
CHAIN

(Skeletonema
marinoi) 		no annotation 5 LEU A 149
PHE A 152
PHE A 112
LEU A 120
LEU A  41
 LOH  A 150 ( 4.3A)
None
None
None
None
 1.28A 3tbgC-6ftlA:
undetectable		 3tbgC-6ftlA:
13.10