SIMILAR PATTERNS OF AMINO ACIDS FOR 3TL9_A_ROCA401_4

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.
1hm7 PENTALENENE SYNTHASE

(Streptomyces
exfoliatus) 		no annotation 4 ASP A  81
ASP A  80
GLY A  85
THR A  94
 None
 1.37A 3tl9B-1hm7A:
undetectable		 3tl9B-1hm7A:
15.15
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1hvc HIV-1 PROTEASE

(Human
immunodeficiency
virus 1) 		PF00077
(RVP) 		4 ASP A  29
ASP A  30
GLY A  48
THR A  80
 A79  A 800 (-2.7A)
A79  A 800 ( 4.7A)
A79  A 800 (-4.1A)
None
 0.37A 3tl9B-1hvcA:
13.1		 3tl9B-1hvcA:
47.78
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1hvc HIV-1 PROTEASE

(Human
immunodeficiency
virus 1) 		PF00077
(RVP) 		4 ASP A  29
ASP A  30
GLY A  48
THR A  80
 A79  A 800 (-2.8A)
A79  A 800 ( 4.9A)
A79  A 800 (-3.6A)
None
 0.40A 3tl9B-1hvcA:
13.1		 3tl9B-1hvcA:
47.78
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.
1iyx ENOLASE

(Enterococcus
hirae) 		PF00113
(Enolase_C)
PF03952
(Enolase_N) 		4 ASP A 291
ASP A 294
GLY A 289
THR A 302
 None
 1.21A 3tl9B-1iyxA:
undetectable		 3tl9B-1iyxA:
13.59
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.
1kfi PHOSPHOGLUCOMUTASE 1

(Paramecium
tetraurelia) 		PF00408
(PGM_PMM_IV)
PF02878
(PGM_PMM_I)
PF02879
(PGM_PMM_II)
PF02880
(PGM_PMM_III) 		4 ASP A 310
ASP A  66
GLY A  64
THR A 205
 ZN  A 700 ( 2.3A)
None
None
None
 1.36A 3tl9B-1kfiA:
undetectable		 3tl9B-1kfiA:
10.99
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.
1li7 CYSTEINYL-TRNA
SYNTHETASE

(Escherichia
coli) 		PF01406
(tRNA-synt_1e)
PF09190
(DALR_2) 		4 ASP A  72
ASP A  71
GLY A 204
THR A 115
 None
 1.01A 3tl9B-1li7A:
undetectable		 3tl9B-1li7A:
13.29
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.
1rxw FLAP
STRUCTURE-SPECIFIC
ENDONUCLEASE

(Archaeoglobus
fulgidus) 		PF00752
(XPG_N)
PF00867
(XPG_I) 		4 ASP A 235
ASP A 174
GLY A 152
THR A 168
 None
 1.33A 3tl9B-1rxwA:
undetectable		 3tl9B-1rxwA:
14.83
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1siv SIV PROTEASE

(Simian
immunodeficiency
virus) 		PF00077
(RVP) 		4 ASP A  29
ASP A  30
GLY A  48
THR A  80
 None
 0.15A 3tl9B-1sivA:
17.7		 3tl9B-1sivA:
51.96
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.
1vma CELL DIVISION
PROTEIN FTSY

(Thermotoga
maritima) 		PF00448
(SRP54)
PF02881
(SRP54_N) 		4 ASP A 129
ASP A 181
GLY A  99
THR A 214
 None
 0.90A 3tl9B-1vmaA:
undetectable		 3tl9B-1vmaA:
18.42
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.
1x90 INVERTASE/PECTIN
METHYLESTERASE
INHIBITOR FAMILY
PROTEIN

(Arabidopsis
thaliana) 		PF04043
(PMEI) 		4 ASP A 113
ASP A 114
GLY A 107
THR A  48
 None
 1.22A 3tl9B-1x90A:
undetectable		 3tl9B-1x90A:
21.48
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.
1xhb POLYPEPTIDE
N-ACETYLGALACTOSAMIN
YLTRANSFERASE 1

(Mus musculus) 		PF00535
(Glycos_transf_2)
PF00652
(Ricin_B_lectin) 		4 ASP A 301
ASP A 299
GLY A 202
THR A 206
 None
 1.21A 3tl9B-1xhbA:
undetectable		 3tl9B-1xhbA:
14.14
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.
1xrc S-ADENOSYLMETHIONINE
SYNTHETASE

(Escherichia
coli) 		PF00438
(S-AdoMet_synt_N)
PF02772
(S-AdoMet_synt_M)
PF02773
(S-AdoMet_synt_C) 		4 ASP A  16
ASP A  20
GLY A  13
THR A  71
 None
 1.06A 3tl9B-1xrcA:
undetectable		 3tl9B-1xrcA:
14.71
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.
1xwi SKD1 PROTEIN

(Homo sapiens) 		PF00004
(AAA)
PF09336
(Vps4_C) 		4 ASP A 378
ASP A 379
GLY A 367
THR A 382
 None
 1.40A 3tl9B-1xwiA:
undetectable		 3tl9B-1xwiA:
16.24
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.
2ag1 BENZALDEHYDE LYASE

(Pseudomonas
fluorescens) 		PF00205
(TPP_enzyme_M)
PF02775
(TPP_enzyme_C)
PF02776
(TPP_enzyme_N) 		4 ASP A 304
ASP A 302
GLY A 309
THR A 284
 None
 1.34A 3tl9B-2ag1A:
undetectable		 3tl9B-2ag1A:
12.40
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.
2c4m GLYCOGEN
PHOSPHORYLASE

(Corynebacterium
callunae) 		PF00343
(Phosphorylase) 		4 ASP A 464
ASP A 463
GLY A 199
THR A  79
 None
None
FMT  A1802 (-3.1A)
None
 1.36A 3tl9B-2c4mA:
undetectable		 3tl9B-2c4mA:
10.99
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.
2d4w GLYCEROL KINASE

(Cellulomonas
sp.) 		PF00370
(FGGY_N)
PF02782
(FGGY_C) 		4 ASP A 197
ASP A 195
GLY A 128
THR A 191
 None
 0.92A 3tl9B-2d4wA:
undetectable		 3tl9B-2d4wA:
13.35
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.
2drw D-AMINO ACID AMIDASE

(Ochrobactrum
anthropi) 		PF00144
(Beta-lactamase) 		4 ASP A 185
ASP A 251
GLY A  52
THR A  34
 None
 1.34A 3tl9B-2drwA:
undetectable		 3tl9B-2drwA:
15.38
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.
2fym ENOLASE

(Escherichia
coli) 		PF00113
(Enolase_C)
PF03952
(Enolase_N) 		4 ASP A 293
ASP A 296
GLY A 291
THR A 304
 None
 1.19A 3tl9B-2fymA:
undetectable		 3tl9B-2fymA:
14.66
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.
2glj PROBABLE M18-FAMILY
AMINOPEPTIDASE 1

(Clostridium
acetobutylicum) 		PF02127
(Peptidase_M18) 		4 ASP A 293
ASP A 107
GLY A 298
THR A 418
 None
 1.38A 3tl9B-2gljA:
undetectable		 3tl9B-2gljA:
12.15
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.
2grv LPQW

(Mycolicibacterium
smegmatis) 		PF00496
(SBP_bac_5) 		4 ASP A 317
ASP A 318
GLY A 314
THR A 567
 None
 0.88A 3tl9B-2grvA:
undetectable		 3tl9B-2grvA:
9.85
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.
2gs5 CONSERVED
HYPOTHETICAL PROTEIN

(Corynebacterium
diphtheriae) 		PF02622
(DUF179) 		4 ASP A 172
ASP A 176
GLY A 169
THR A 166
 None
 1.38A 3tl9B-2gs5A:
undetectable		 3tl9B-2gs5A:
22.01
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.
2im5 NICOTINATE
PHOSPHORIBOSYLTRANSF
ERASE

(Porphyromonas
gingivalis) 		PF04095
(NAPRTase) 		4 ASP A 306
ASP A 275
GLY A 329
THR A 246
 None
 1.32A 3tl9B-2im5A:
undetectable		 3tl9B-2im5A:
16.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2iny HEXON PROTEIN

(Fowl
aviadenovirus A) 		PF01065
(Adeno_hexon)
PF03678
(Adeno_hexon_C) 		4 ASP A 195
ASP A 197
GLY A 200
THR A 235
 None
 1.34A 3tl9B-2inyA:
undetectable		 3tl9B-2inyA:
6.38
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.
2ntb PECTINESTERASE A

(Dickeya
dadantii) 		PF01095
(Pectinesterase) 		4 ASP A 178
ASP A 199
GLY A 203
THR A 289
 None
 1.35A 3tl9B-2ntbA:
undetectable		 3tl9B-2ntbA:
14.04
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.
2p6w PUTATIVE
GLYCOSYLTRANSFERASE
(MANNOSYLTRANSFERASE
) INVOLVED IN
GLYCOSYLATING THE
PBCV-1 MAJOR CAPSID
PROTEIN

(Paramecium
bursaria
Chlorella virus
1) 		PF05637
(Glyco_transf_34) 		4 ASP A  78
ASP A  80
GLY A  11
THR A  17
 MN  A 214 ( 3.2A)
MN  A 214 ( 2.4A)
None
None
 1.36A 3tl9B-2p6wA:
undetectable		 3tl9B-2p6wA:
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.
2p76 GLYCEROPHOSPHORYL
DIESTER
PHOSPHODIESTERASE

(Staphylococcus
aureus) 		PF03009
(GDPD) 		4 ASP A 255
ASP A 258
GLY A 253
THR A 264
 None
 1.22A 3tl9B-2p76A:
undetectable		 3tl9B-2p76A:
18.52
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.
2qtk PROBABLE PORIN

(Pseudomonas
aeruginosa) 		PF03573
(OprD) 		4 ASP A 245
ASP A 272
GLY A 274
THR A 332
 None
 1.11A 3tl9B-2qtkA:
undetectable		 3tl9B-2qtkA:
14.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2r39 FIXG-RELATED PROTEIN

(Vibrio
parahaemolyticus) 		PF11614
(FixG_C) 		4 ASP A 453
ASP A 427
GLY A 451
THR A 462
 None
 1.40A 3tl9B-2r39A:
undetectable		 3tl9B-2r39A:
18.02
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.
2ral SERINE-ASPARTATE
REPEAT-CONTAINING
PROTEIN G

(Staphylococcus
epidermidis) 		PF10425
(SdrG_C_C) 		4 ASP A 378
ASP A 375
GLY A 324
THR A 359
 None
 1.30A 3tl9B-2ralA:
undetectable		 3tl9B-2ralA:
17.00
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.
2rjb UNCHARACTERIZED
PROTEIN

(Shigella
flexneri) 		PF07063
(DUF1338) 		4 ASP A 307
ASP A 308
GLY A 302
THR A 332
 None
 1.07A 3tl9B-2rjbA:
undetectable		 3tl9B-2rjbA:
13.42
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2rkf PROTEASE RETROPEPSIN

(Human
immunodeficiency
virus 1) 		PF00077
(RVP) 		4 ASP A  29
ASP A  30
GLY A  48
THR A  80
 AB1  A 501 ( 3.3A)
AB1  A 501 (-3.8A)
AB1  A 501 (-4.2A)
None
 0.26A 3tl9B-2rkfA:
19.6		 3tl9B-2rkfA:
82.83
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.
2x30 PHOSPHORIBOSYL
ISOMERASE A

(Streptomyces
coelicolor) 		PF00977
(His_biosynth) 		4 ASP A  62
ASP A  53
GLY A  59
THR A 105
 None
None
None
SO4  A1241 (-3.4A)
 1.37A 3tl9B-2x30A:
undetectable		 3tl9B-2x30A:
18.03
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.
2x31 MAGNESIUM-CHELATASE
60 KDA SUBUNIT

(Rhodobacter
capsulatus) 		PF13519
(VWA_2) 		4 ASP A 113
ASP A  16
GLY A  82
THR A  55
 None
 1.09A 3tl9B-2x31A:
undetectable		 3tl9B-2x31A:
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.
2ze4 PHOSPHOLIPASE D

(Streptomyces
antibioticus) 		PF13091
(PLDc_2) 		4 ASP A 189
ASP A 190
GLY A 186
THR A  50
 None
 1.18A 3tl9B-2ze4A:
undetectable		 3tl9B-2ze4A:
11.35
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.
3c8z CYSTEINYL-TRNA
SYNTHETASE

(Mycolicibacterium
smegmatis) 		PF01406
(tRNA-synt_1e) 		4 ASP A  87
ASP A  86
GLY A 226
THR A 130
 None
 0.91A 3tl9B-3c8zA:
undetectable		 3tl9B-3c8zA:
13.27
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.
3dlj BETA-ALA-HIS
DIPEPTIDASE

(Homo sapiens) 		PF01546
(Peptidase_M20)
PF07687
(M20_dimer) 		4 ASP A 139
ASP A 202
GLY A 445
THR A 214
 ZN  A2001 ( 2.4A)
ZN  A2002 ( 2.1A)
None
None
 1.33A 3tl9B-3dljA:
undetectable		 3tl9B-3dljA:
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.
3eey PUTATIVE RRNA
METHYLASE

(Ruminiclostridium
thermocellum) 		PF06962
(rRNA_methylase) 		4 ASP A  34
ASP A  26
GLY A  30
THR A  62
 SAM  A 300 (-3.9A)
SAM  A 300 ( 4.5A)
SAM  A 300 (-3.4A)
None
 1.36A 3tl9B-3eeyA:
undetectable		 3tl9B-3eeyA:
18.81
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.
3eq2 PROBABLE
TWO-COMPONENT
RESPONSE REGULATOR

(Pseudomonas
aeruginosa) 		PF00072
(Response_reg)
PF07228
(SpoIIE) 		4 ASP A 383
ASP A 192
GLY A 213
THR A 268
 None
 1.08A 3tl9B-3eq2A:
undetectable		 3tl9B-3eq2A:
14.40
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.
3fah ALDEHYDE
OXIDOREDUCTASE

(Desulfovibrio
gigas) 		PF00111
(Fer2)
PF01315
(Ald_Xan_dh_C)
PF01799
(Fer2_2)
PF02738
(Ald_Xan_dh_C2) 		4 ASP A 198
ASP A 194
GLY A 191
THR A 184
 None
 0.90A 3tl9B-3fahA:
undetectable		 3tl9B-3fahA:
8.48
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.
3gyb TRANSCRIPTIONAL
REGULATORS
(LACI-FAMILY
TRANSCRIPTIONAL
REGULATORY PROTEIN)

(Corynebacterium
glutamicum) 		PF13377
(Peripla_BP_3) 		4 ASP A 286
ASP A 287
GLY A 291
THR A 316
 None
MG  A   1 (-2.6A)
None
None
 1.09A 3tl9B-3gybA:
undetectable		 3tl9B-3gybA:
16.78
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.
3hno PYROPHOSPHATE-DEPEND
ENT
PHOSPHOFRUCTOKINASE

(Nitrosospira
multiformis) 		PF00365
(PFK) 		4 ASP A 144
ASP A 146
GLY A 113
THR A 150
 None
 1.32A 3tl9B-3hnoA:
undetectable		 3tl9B-3hnoA:
12.23
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.
3hrd NICOTINATE
DEHYDROGENASE LARGE
MOLYBDOPTERIN
SUBUNIT
NICOTINATE
DEHYDROGENASE MEDIUM
MOLYBDOPTERIN
SUBUNIT

(Eubacterium
barkeri) 		PF01315
(Ald_Xan_dh_C)
PF02738
(Ald_Xan_dh_C2) 		4 ASP A  16
ASP B  44
GLY A 236
THR A 207
 None
None
None
MG  A 426 (-3.8A)
 1.28A 3tl9B-3hrdA:
undetectable		 3tl9B-3hrdA:
11.97
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.
3k2j PROTEIN POLYBROMO-1

(Homo sapiens) 		PF00439
(Bromodomain) 		4 ASP A 460
ASP A 459
GLY A 346
THR A 412
 None
None
CL  A   1 (-4.3A)
None
 1.39A 3tl9B-3k2jA:
undetectable		 3tl9B-3k2jA:
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.
3k2k PUTATIVE
CARBOXYPEPTIDASE

(Burkholderia
mallei) 		PF00246
(Peptidase_M14) 		4 ASP A 272
ASP A 270
GLY A 314
THR A 342
 None
 1.39A 3tl9B-3k2kA:
undetectable		 3tl9B-3k2kA:
12.75
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.
3k2q PYROPHOSPHATE-DEPEND
ENT
PHOSPHOFRUCTOKINASE

(Marinobacter
hydrocarbonoclasticus) 		PF00365
(PFK) 		4 ASP A 144
ASP A 146
GLY A 113
THR A 150
 None
 1.27A 3tl9B-3k2qA:
undetectable		 3tl9B-3k2qA:
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.
3la6 TYROSINE-PROTEIN
KINASE WZC

(Escherichia
coli) 		PF13614
(AAA_31) 		4 ASP A 564
ASP A 642
GLY A 533
THR A 662
 CA  A1001 (-4.6A)
CA  A1001 ( 4.0A)
None
None
 1.14A 3tl9B-3la6A:
undetectable		 3tl9B-3la6A:
19.85
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.
3lmd GERANYLGERANYL
PYROPHOSPHATE
SYNTHASE

(Corynebacterium
glutamicum) 		PF00348
(polyprenyl_synt) 		4 ASP A 242
ASP A 239
GLY A  18
THR A 345
 None
 1.36A 3tl9B-3lmdA:
undetectable		 3tl9B-3lmdA:
15.36
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.
3lqu 3,4-DIHYDROXY-2-BUTA
NONE 4-PHOSPHATE
SYNTHASE

(Salmonella
enterica) 		PF00926
(DHBP_synthase) 		4 ASP A  34
ASP A  33
GLY A 151
THR A 157
 None
 1.38A 3tl9B-3lquA:
undetectable		 3tl9B-3lquA:
18.48
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.
3muo PROLYL ENDOPEPTIDASE

(Aeromonas
caviae) 		PF00326
(Peptidase_S9)
PF02897
(Peptidase_S9_N) 		4 ASP A 623
ASP A 622
GLY A 148
THR A 653
 None
 1.27A 3tl9B-3muoA:
undetectable		 3tl9B-3muoA:
10.18
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.
3ncy ADIC

(Salmonella
enterica) 		PF13520
(AA_permease_2) 		4 ASP A 306
ASP A 307
GLY A  71
THR A  89
 None
 1.28A 3tl9B-3ncyA:
undetectable		 3tl9B-3ncyA:
12.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3nsj PERFORIN-1

(Mus musculus) 		PF00168
(C2)
PF01823
(MACPF) 		4 ASP A 227
ASP A 339
GLY A 230
THR A 172
 None
 1.34A 3tl9B-3nsjA:
undetectable		 3tl9B-3nsjA:
11.64
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.
3o75 FRUCTOSE TRANSPORT
SYSTEM REPRESSOR
FRUR

(Pseudomonas
putida) 		PF00532
(Peripla_BP_1) 		4 ASP A 235
ASP A 234
GLY A 238
THR A 257
 None
 1.08A 3tl9B-3o75A:
undetectable		 3tl9B-3o75A:
17.36
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.
3rxz POLYSACCHARIDE
DEACETYLASE

(Mycolicibacterium
smegmatis) 		PF01522
(Polysacc_deac_1) 		4 ASP A  29
ASP A  31
GLY A 105
THR A  38
 ZN  A 299 ( 4.4A)
ZN  A 299 (-2.1A)
None
None
 1.30A 3tl9B-3rxzA:
undetectable		 3tl9B-3rxzA:
15.95
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.
3sy6 FIMBRIAL PROTEIN
BF1861

(Bacteroides
fragilis) 		PF13149
(Mfa_like_1) 		4 ASP A  82
ASP A  83
GLY A  80
THR A  29
 None
 1.08A 3tl9B-3sy6A:
undetectable		 3tl9B-3sy6A:
15.96
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3t3c HIV-1 PROTEASE

(Human
immunodeficiency
virus 1) 		PF00077
(RVP) 		4 ASP A  29
ASP A  30
GLY A  49
THR A  80
 017  A 201 (-3.5A)
017  A 201 (-4.2A)
017  A 201 (-4.0A)
None
 0.88A 3tl9B-3t3cA:
17.1		 3tl9B-3t3cA:
74.75
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3ttp HIV-1 PROTEASE

(Human
immunodeficiency
virus 1) 		PF00077
(RVP) 		4 ASP A  29
ASP A  30
GLY A  48
THR A  80
 017  A 201 (-3.3A)
017  A 201 (-4.6A)
None
None
 0.48A 3tl9B-3ttpA:
18.2		 3tl9B-3ttpA:
76.77
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3u7s POL POLYPROTEIN

(Human
immunodeficiency
virus 1) 		PF00077
(RVP) 		4 ASP A  29
ASP A  30
GLY A  48
THR A  80
 017  A 201 (-3.2A)
017  A 201 ( 4.0A)
017  A 202 ( 4.6A)
None
 0.37A 3tl9B-3u7sA:
18.6		 3tl9B-3u7sA:
76.77
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.
3ue9 ADENYLOSUCCINATE
SYNTHETASE

(Burkholderia
thailandensis) 		PF00709
(Adenylsucc_synt) 		4 ASP A 296
ASP A 294
GLY A 284
THR A 281
 None
 1.06A 3tl9B-3ue9A:
undetectable		 3tl9B-3ue9A:
13.39
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.
3uj2 ENOLASE 1

(Anaerostipes
caccae) 		PF00113
(Enolase_C)
PF03952
(Enolase_N) 		4 ASP A 293
ASP A 296
GLY A 291
THR A 304
 None
 1.16A 3tl9B-3uj2A:
undetectable		 3tl9B-3uj2A:
13.55
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.
3uk1 TRANSKETOLASE

(Burkholderia
thailandensis) 		PF00456
(Transketolase_N)
PF02779
(Transket_pyr)
PF02780
(Transketolase_C) 		4 ASP A 514
ASP A 614
GLY A 563
THR A 584
 None
 1.32A 3tl9B-3uk1A:
undetectable		 3tl9B-3uk1A:
9.37
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.
3wbn PUTATIVE
UNCHARACTERIZED
PROTEIN

(Pyrococcus
furiosus) 		PF01554
(MatE) 		4 ASP A  41
ASP A 184
GLY A 197
THR A 190
 None
 1.17A 3tl9B-3wbnA:
undetectable		 3tl9B-3wbnA:
12.95
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.
4a3r ENOLASE

(Bacillus
subtilis) 		PF00113
(Enolase_C)
PF03952
(Enolase_N) 		4 ASP A 291
ASP A 294
GLY A 289
THR A 302
 None
 1.20A 3tl9B-4a3rA:
undetectable		 3tl9B-4a3rA:
13.30
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.
4b6z FAMILY M14
UNASSIGNED PEPTIDASE

(Burkholderia
cenocepacia) 		PF00246
(Peptidase_M14) 		4 ASP A 272
ASP A 270
GLY A 314
THR A 342
 None
 1.37A 3tl9B-4b6zA:
undetectable		 3tl9B-4b6zA:
13.18
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.
4bq4 B-AGARASE

(Saccharophagus
degradans) 		PF02449
(Glyco_hydro_42) 		4 ASP A 765
ASP A 746
GLY A 704
THR A 750
 GOL  A1798 (-4.9A)
GOL  A1798 (-3.8A)
GOL  A1798 (-3.7A)
None
 1.07A 3tl9B-4bq4A:
undetectable		 3tl9B-4bq4A:
8.90
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.
4c51 CATALASE-PEROXIDASE

(Mycobacterium
tuberculosis) 		PF00141
(peroxidase) 		4 ASP A 511
ASP A 509
GLY A 504
THR A 475
 None
 1.19A 3tl9B-4c51A:
undetectable		 3tl9B-4c51A:
9.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4da9 SHORT-CHAIN
DEHYDROGENASE/REDUCT
ASE

(Sinorhizobium
meliloti) 		PF13561
(adh_short_C2) 		4 ASP A  67
ASP A  64
GLY A 120
THR A  12
 None
 1.21A 3tl9B-4da9A:
undetectable		 3tl9B-4da9A:
18.15
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.
4ewj ENOLASE 2

(Streptococcus
suis) 		PF00113
(Enolase_C)
PF03952
(Enolase_N) 		4 ASP A 296
ASP A 299
GLY A 294
THR A 307
 None
 1.23A 3tl9B-4ewjA:
undetectable		 3tl9B-4ewjA:
16.03
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.
4j5u SERINE
HYDROXYMETHYLTRANSFE
RASE

(Rickettsia
rickettsii) 		PF00464
(SHMT) 		4 ASP A 307
ASP A 321
GLY A 326
THR A 358
 None
 1.33A 3tl9B-4j5uA:
undetectable		 3tl9B-4j5uA:
15.50
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.
4l9z MALYL-COA LYASE

(Rhodobacter
sphaeroides) 		PF03328
(HpcH_HpaI) 		4 ASP A 229
ASP A 226
GLY A 181
THR A 178
 None
 1.34A 3tl9B-4l9zA:
undetectable		 3tl9B-4l9zA:
13.52
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.
4l9z MALYL-COA LYASE

(Rhodobacter
sphaeroides) 		PF03328
(HpcH_HpaI) 		4 ASP A 229
ASP A 226
GLY A 182
THR A 178
 None
 1.29A 3tl9B-4l9zA:
undetectable		 3tl9B-4l9zA:
13.52
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.
4m8d PUTATIVE
UNCHARACTERIZED
PROTEIN

(Labrenzia
aggregata) 		PF04199
(Cyclase) 		4 ASP A 121
ASP A 119
GLY A 173
THR A 125
 None
CA  A 303 ( 4.8A)
None
None
 1.39A 3tl9B-4m8dA:
undetectable		 3tl9B-4m8dA:
18.32
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.
4o3s DNA POLYMERASE ETA

(Homo sapiens) 		PF00817
(IMS)
PF11799
(IMS_C) 		4 ASP A  66
ASP A  67
GLY A  46
THR A  60
 None
 1.06A 3tl9B-4o3sA:
undetectable		 3tl9B-4o3sA:
13.48
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.
4p5n HYPOTHETICAL PROTEIN
CNAG_02591

(Cryptococcus
neoformans) 		no annotation 4 ASP A  75
ASP A  73
GLY A  31
THR A  22
 None
None
None
CD  A 101 (-2.8A)
 1.28A 3tl9B-4p5nA:
undetectable		 3tl9B-4p5nA:
22.55
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.
4roq MALYL-COA
LYASE/BETA-METHYLMAL
YL-COA LYASE

(Methylobacterium
extorquens) 		PF03328
(HpcH_HpaI) 		4 ASP A 234
ASP A 231
GLY A 180
THR A 177
 None
 1.39A 3tl9B-4roqA:
undetectable		 3tl9B-4roqA:
14.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4roq MALYL-COA
LYASE/BETA-METHYLMAL
YL-COA LYASE

(Methylobacterium
extorquens) 		PF03328
(HpcH_HpaI) 		4 ASP A 234
ASP A 231
GLY A 181
THR A 177
 None
 1.28A 3tl9B-4roqA:
undetectable		 3tl9B-4roqA:
14.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4uoz BETA-GALACTOSIDASE

(Bifidobacterium
animalis) 		PF02449
(Glyco_hydro_42)
PF08532
(Glyco_hydro_42M)
PF08533
(Glyco_hydro_42C) 		4 ASP A 631
ASP A 629
GLY A 635
THR A 458
 None
 1.29A 3tl9B-4uozA:
undetectable		 3tl9B-4uozA:
11.04
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.
4wr3 ALANINE RACEMASE,
BIOSYNTHETIC

(Escherichia
coli) 		PF00842
(Ala_racemase_C)
PF01168
(Ala_racemase_N) 		4 ASP A 316
ASP A 320
GLY A 292
THR A 238
 None
 1.20A 3tl9B-4wr3A:
undetectable		 3tl9B-4wr3A:
15.66
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.
4y1g UNCHARACTERIZED
PROTEIN SAV1875

(Staphylococcus
aureus) 		PF01965
(DJ-1_PfpI) 		4 ASP A 115
ASP A 116
GLY A  88
THR A 101
 None
 1.30A 3tl9B-4y1gA:
undetectable		 3tl9B-4y1gA:
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.
4zpl PROTEIN PCDHB1

(Mus musculus) 		PF00028
(Cadherin)
PF08266
(Cadherin_2) 		4 ASP A 131
ASP A 188
GLY A 196
THR A 143
 CA  A 415 (-2.5A)
CA  A 415 (-3.6A)
None
NAG  A 401 (-4.7A)
 1.38A 3tl9B-4zplA:
undetectable		 3tl9B-4zplA:
14.52
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.
4zpq MCG133388, ISOFORM
CRA_F

(Mus musculus) 		PF00028
(Cadherin)
PF08266
(Cadherin_2) 		4 ASP A 130
ASP A 187
GLY A 195
THR A 142
 CA  A 404 (-2.4A)
CA  A 404 (-3.8A)
None
None
 1.39A 3tl9B-4zpqA:
undetectable		 3tl9B-4zpqA:
16.31
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5b18 PROTEASE

(Human
immunodeficiency
virus 1) 		PF00077
(RVP) 		4 ASP A  29
ASP A  30
GLY A  48
THR A  80
 None
 0.42A 3tl9B-5b18A:
17.0		 3tl9B-5b18A:
73.74
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.
5b8h TYPE III
PANTOTHENATE KINASE

(Burkholderia
cenocepacia) 		PF03309
(Pan_kinase) 		4 ASP A 230
ASP A 231
GLY A 226
THR A 131
 None
None
2PN  A 301 ( 4.9A)
None
 1.31A 3tl9B-5b8hA:
undetectable		 3tl9B-5b8hA:
16.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5boe ENOLASE

(Staphylococcus
aureus) 		PF00113
(Enolase_C)
PF03952
(Enolase_N) 		4 ASP A 295
ASP A 298
GLY A 293
THR A 306
 None
 1.23A 3tl9B-5boeA:
undetectable		 3tl9B-5boeA:
15.20
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.
5cvw BIFUNCTIONAL
HEMOLYSIN/ADENYLATE
CYCLASE

(Bordetella
pertussis) 		PF00353
(HemolysinCabind)
PF06594
(HCBP_related) 		4 ASP A1560
ASP A1579
GLY A1597
THR A1641
 None
CA  A1702 ( 2.4A)
CA  A1703 ( 4.5A)
None
 1.26A 3tl9B-5cvwA:
undetectable		 3tl9B-5cvwA:
21.05
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.
5cyr RNA-DEPENDENT RNA
POLYMERASE

(Thosea asigna
virus) 		no annotation 4 ASP B 351
ASP B 447
GLY B 375
THR B 381
 ATP  B 701 (-2.4A)
None
None
None
 1.34A 3tl9B-5cyrB:
undetectable		 3tl9B-5cyrB:
8.95
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.
5eo3 PROTEIN PELOTA
HOMOLOG

(Homo sapiens) 		PF03465
(eRF1_3) 		4 ASP A 279
ASP A 280
GLY A 273
THR A 342
 None
 1.33A 3tl9B-5eo3A:
undetectable		 3tl9B-5eo3A:
20.80
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.
5erd DESMOGLEIN-2

(Homo sapiens) 		PF00028
(Cadherin) 		4 ASP A 250
ASP A 248
GLY A 253
THR A 276
 CA  A 619 ( 3.6A)
CA  A 621 (-2.2A)
None
None
 1.32A 3tl9B-5erdA:
undetectable		 3tl9B-5erdA:
11.55
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5f56 SINGLE-STRANDED-DNA-
SPECIFIC EXONUCLEASE

(Deinococcus
radiodurans) 		PF01368
(DHH)
PF02272
(DHHA1) 		4 ASP A  81
ASP A  83
GLY A  78
THR A  90
 MN  A 804 (-1.9A)
MN  A 805 (-3.3A)
None
None
 1.39A 3tl9B-5f56A:
undetectable		 3tl9B-5f56A:
9.83
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.
5g0h HDAC6

(Danio rerio) 		PF00850
(Hist_deacetyl) 		4 ASP A 612
ASP A 610
GLY A 572
THR A 592
 ZN  A1804 (-2.1A)
K  A1802 (-3.2A)
None
None
 1.09A 3tl9B-5g0hA:
undetectable		 3tl9B-5g0hA:
10.34
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.
5gne LEUCINE
AMINOPEPTIDASE

(Legionella
pneumophila) 		PF04389
(Peptidase_M28) 		4 ASP A 227
ASP A 288
GLY A 211
THR A 351
 ZN  A 402 ( 4.8A)
ZN  A 402 (-1.9A)
None
None
 1.35A 3tl9B-5gneA:
undetectable		 3tl9B-5gneA:
14.99
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.
5gqf LACTO-N-BIOSIDASE

(Bifidobacterium
longum) 		no annotation 4 ASP A 179
ASP A 178
GLY A 239
THR A 159
 None
CA  A 701 (-2.9A)
None
None
 1.37A 3tl9B-5gqfA:
undetectable		 3tl9B-5gqfA:
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.
5gw5 T-COMPLEX PROTEIN 1
SUBUNIT EPSILON

(Saccharomyces
cerevisiae) 		PF00118
(Cpn60_TCP1) 		4 ASP e 390
ASP e 246
GLY e 228
THR e 405
 None
 1.33A 3tl9B-5gw5e:
undetectable		 3tl9B-5gw5e:
11.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5j5j DESMOCOLLIN-2,DESMOG
LEIN-2

(Homo sapiens) 		PF00028
(Cadherin) 		4 ASP A 248
ASP A 246
GLY A 251
THR A 274
 CA  A 626 ( 3.7A)
CA  A 627 (-2.2A)
None
None
 1.29A 3tl9B-5j5jA:
undetectable		 3tl9B-5j5jA:
12.18
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.
5lw3 POLY(BETA-D-MANNURON
ATE) C5 EPIMERASE 6

(Azotobacter
vinelandii) 		no annotation 4 ASP A  17
ASP A  18
GLY A  14
THR A  73
 None
 1.36A 3tl9B-5lw3A:
undetectable		 3tl9B-5lw3A:
16.01
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.
5n7q PUTATIVE CATHEPSIN D

(Ixodes ricinus) 		no annotation 4 ASP A 329
ASP A 327
GLY A 176
THR A 324
 None
 1.29A 3tl9B-5n7qA:
6.8		 3tl9B-5n7qA:
18.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5t3p PEROXISOMAL COENZYME
A DIPHOSPHATASE
NUDT7

(Homo sapiens) 		PF00293
(NUDIX) 		4 ASP A  80
ASP A  83
GLY A  77
THR A 123
 None
 0.91A 3tl9B-5t3pA:
undetectable		 3tl9B-5t3pA:
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.
5t88 PROLYL ENDOPEPTIDASE

(Pyrococcus
furiosus) 		PF00326
(Peptidase_S9)
PF02897
(Peptidase_S9_N) 		4 ASP A 561
ASP A 560
GLY A 591
THR A 588
 None
 1.09A 3tl9B-5t88A:
undetectable		 3tl9B-5t88A:
11.62
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.
5ugj 4-HYDROXY-TETRAHYDRO
DIPICOLINATE
REDUCTASE

(Neisseria
meningitidis) 		no annotation 4 ASP A 105
ASP A 104
GLY A 102
THR A  82
 None
 1.22A 3tl9B-5ugjA:
undetectable		 3tl9B-5ugjA:
21.70
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.
5vcs ALPHA-1,6-MANNOSYL-G
LYCOPROTEIN
2-BETA-N-ACETYLGLUCO
SAMINYLTRANSFERASE

(Homo sapiens) 		no annotation 4 ASP A 433
ASP A 436
GLY A 430
THR A 349
 None
None
NAG  A 501 ( 3.2A)
None
 1.08A 3tl9B-5vcsA:
undetectable		 3tl9B-5vcsA:
29.21
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
6upj HIV-2 PROTEASE

(Human
immunodeficiency
virus 2) 		PF00077
(RVP) 		4 ASP A  29
ASP A  30
GLY A  48
THR A  80
 None
 0.66A 3tl9B-6upjA:
17.1		 3tl9B-6upjA:
49.49