SIMILAR PATTERNS OF AMINO ACIDS FOR 3TM4_A_SAMA401_1

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.
1ae9 LAMBDA INTEGRASE

(Escherichia
virus Lambda) 		PF00589
(Phage_integrase) 		4 SER A 281
THR A 284
GLU A 218
ASP A 223
 None
 1.40A 3tm4A-1ae9A:
undetectable		 3tm4A-1ae9A:
22.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1boo PROTEIN (N-4
CYTOSINE-SPECIFIC
METHYLTRANSFERASE
PVU II)

(Proteus
vulgaris) 		PF01555
(N6_N4_Mtase) 		5 HIS A 246
SER A 276
THR A 278
GLU A 294
ASP A  34
 SAH  A 401 (-4.0A)
SAH  A 401 (-2.7A)
SAH  A 401 (-4.0A)
SAH  A 401 (-2.9A)
SAH  A 401 (-4.0A)
 0.49A 3tm4A-1booA:
undetectable		 3tm4A-1booA:
24.25
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.
1cfr RESTRICTION
ENDONUCLEASE

(Citrobacter
freundii) 		PF07832
(Bse634I) 		4 HIS A 203
SER A 206
THR A 249
ASP A 101
 None
 1.43A 3tm4A-1cfrA:
undetectable		 3tm4A-1cfrA:
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.
1d2o COLLAGEN ADHESIN

(Staphylococcus
aureus) 		PF05738
(Cna_B) 		4 SER A 560
THR A 572
GLU A 603
ASP A 612
 None
 1.43A 3tm4A-1d2oA:
undetectable		 3tm4A-1d2oA:
19.84
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.
1d2p COLLAGEN ADHESIN

(Staphylococcus
aureus) 		PF05738
(Cna_B) 		4 SER A 560
THR A 572
GLU A 603
ASP A 612
 None
 1.40A 3tm4A-1d2pA:
undetectable		 3tm4A-1d2pA:
20.27
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.
1d2p COLLAGEN ADHESIN

(Staphylococcus
aureus) 		PF05738
(Cna_B) 		4 SER A 747
THR A 759
GLU A 790
ASP A 799
 None
 1.44A 3tm4A-1d2pA:
undetectable		 3tm4A-1d2pA:
20.27
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.
1d6h CHALCONE SYNTHASE

(Medicago sativa) 		PF00195
(Chal_sti_synt_N)
PF02797
(Chal_sti_synt_C) 		4 SER A 386
THR A 360
GLU A 238
ASP A 227
 None
 1.07A 3tm4A-1d6hA:
2.5		 3tm4A-1d6hA:
22.06
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1e09 PRU AV 1

(Prunus avium) 		PF00407
(Bet_v_1) 		4 HIS A 119
SER A 118
GLU A 101
ASP A  75
 None
 1.38A 3tm4A-1e09A:
undetectable		 3tm4A-1e09A:
18.31
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.
1g43 SCAFFOLDING PROTEIN

([Clostridium]
cellulolyticum) 		PF00942
(CBM_3) 		4 SER A 111
THR A  29
GLU A 113
ASP A  60
 None
 1.43A 3tm4A-1g43A:
undetectable		 3tm4A-1g43A:
16.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ia7 CELLULASE CEL9M

([Clostridium]
cellulolyticum) 		PF00759
(Glyco_hydro_9) 		4 SER A 159
THR A 163
GLU A 157
ASP A 258
 None
None
None
EDO  A1337 (-4.4A)
 1.30A 3tm4A-1ia7A:
undetectable		 3tm4A-1ia7A:
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.
1jov HI1317

(Haemophilus
influenzae) 		PF01263
(Aldose_epim) 		4 HIS A 218
SER A 263
THR A 136
GLU A 265
 None
 1.29A 3tm4A-1jovA:
undetectable		 3tm4A-1jovA:
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.
1mb9 BETA-LACTAM
SYNTHETASE

(Streptomyces
clavuligerus) 		PF00733
(Asn_synthase)
PF13537
(GATase_7) 		4 SER A 455
THR A 302
GLU A 325
ASP A 320
 None
 1.42A 3tm4A-1mb9A:
4.2		 3tm4A-1mb9A:
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.
1nr0 ACTIN INTERACTING
PROTEIN 1

(Caenorhabditis
elegans) 		PF00400
(WD40)
PF12894
(ANAPC4_WD40) 		4 HIS A  93
THR A  56
GLU A  53
ASP A  31
 None
 1.38A 3tm4A-1nr0A:
undetectable		 3tm4A-1nr0A:
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.
1nt2 FIBRILLARIN-LIKE
PRE-RRNA PROCESSING
PROTEIN

(Archaeoglobus
fulgidus) 		PF01269
(Fibrillarin) 		4 SER A  68
THR A  70
GLU A  88
ASP A 113
 SAM  A 301 ( 3.8A)
SAM  A 301 (-3.1A)
SAM  A 301 (-2.4A)
SAM  A 301 (-3.6A)
 0.64A 3tm4A-1nt2A:
14.4		 3tm4A-1nt2A:
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.
1pp1 P40 NUCLEOPROTEIN

(Borna disease
virus) 		PF06407
(BDV_P40) 		4 HIS X  44
SER X  99
THR X  73
GLU X  98
 None
 1.40A 3tm4A-1pp1X:
undetectable		 3tm4A-1pp1X:
22.52
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.
1tf0 SERUM ALBUMIN

(Homo sapiens) 		PF00273
(Serum_albumin) 		4 SER A  65
THR A  68
GLU A   6
ASP A 255
 None
 1.44A 3tm4A-1tf0A:
undetectable		 3tm4A-1tf0A:
21.31
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1u0u DIHYDROPINOSYLVIN
SYNTHASE

(Pinus
sylvestris) 		PF00195
(Chal_sti_synt_N)
PF02797
(Chal_sti_synt_C) 		4 SER A 389
THR A 363
GLU A 241
ASP A 230
 None
 1.17A 3tm4A-1u0uA:
undetectable		 3tm4A-1u0uA:
23.23
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.
1wln AFADIN

(Mus musculus) 		PF00498
(FHA) 		4 HIS A 107
SER A 106
GLU A  16
ASP A  26
 None
 1.43A 3tm4A-1wlnA:
undetectable		 3tm4A-1wlnA:
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.
1x5h NEOGENIN

(Homo sapiens) 		PF00041
(fn3) 		4 HIS A  38
SER A  26
GLU A  28
ASP A 119
 None
 1.40A 3tm4A-1x5hA:
undetectable		 3tm4A-1x5hA:
17.53
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.
1yhp CALCIUM-DEPENDENT
CELL ADHESION
MOLECULE-1

(Dictyostelium
discoideum) 		PF08964
(Crystall_3)
PF14564
(Membrane_bind) 		4 HIS A 153
SER A 170
THR A 190
ASP A 164
 None
 1.29A 3tm4A-1yhpA:
undetectable		 3tm4A-1yhpA:
18.38
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.
1z1e STILBENE SYNTHASE

(Arachis
hypogaea) 		PF00195
(Chal_sti_synt_N)
PF02797
(Chal_sti_synt_C) 		4 SER A 386
THR A 360
GLU A 238
ASP A 227
 None
 0.92A 3tm4A-1z1eA:
undetectable		 3tm4A-1z1eA:
23.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1zg4 BETA-LACTAMASE TEM

(Escherichia
coli) 		PF13354
(Beta-lactamase2) 		4 SER A 124
THR A 128
GLU A 121
ASP A 115
 None
 1.37A 3tm4A-1zg4A:
undetectable		 3tm4A-1zg4A:
21.74
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.
1zr6 GLUCOOLIGOSACCHARIDE
OXIDASE

(Sarocladium
strictum) 		PF01565
(FAD_binding_4)
PF08031
(BBE) 		4 HIS A 127
SER A 126
THR A 148
ASP A 290
 None
 1.16A 3tm4A-1zr6A:
undetectable		 3tm4A-1zr6A:
23.35
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.
1zsw GLYOXALASE FAMILY
PROTEIN

(Bacillus cereus) 		PF00903
(Glyoxalase) 		4 HIS A 139
SER A  55
THR A  53
ASP A 230
 None
 1.44A 3tm4A-1zswA:
undetectable		 3tm4A-1zswA:
22.64
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.
2d52 PENTAKETIDE CHROMONE
SYNTHASE

(Aloe
arborescens) 		PF00195
(Chal_sti_synt_N)
PF02797
(Chal_sti_synt_C) 		4 HIS A 401
SER A 402
THR A 376
ASP A 240
 None
 1.41A 3tm4A-2d52A:
undetectable		 3tm4A-2d52A:
23.13
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.
2d52 PENTAKETIDE CHROMONE
SYNTHASE

(Aloe
arborescens) 		PF00195
(Chal_sti_synt_N)
PF02797
(Chal_sti_synt_C) 		4 SER A 402
THR A 376
GLU A 251
ASP A 240
 None
 1.44A 3tm4A-2d52A:
undetectable		 3tm4A-2d52A:
23.13
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.
2ipx RRNA
2'-O-METHYLTRANSFERA
SE FIBRILLARIN

(Homo sapiens) 		PF01269
(Fibrillarin) 		4 SER A 171
THR A 173
GLU A 192
ASP A 217
 None
None
MTA  A4001 (-2.7A)
MTA  A4001 (-3.4A)
 1.15A 3tm4A-2ipxA:
14.6		 3tm4A-2ipxA:
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.
2iv2 FORMATE
DEHYDROGENASE H

(Escherichia
coli) 		PF00384
(Molybdopterin)
PF01568
(Molydop_binding)
PF04879
(Molybdop_Fe4S4) 		4 HIS X 451
THR X   6
GLU X 450
ASP X  54
 2MD  X 801 (-4.7A)
None
None
None
 1.41A 3tm4A-2iv2X:
undetectable		 3tm4A-2iv2X:
20.69
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.
2oga TRANSAMINASE

(Streptomyces
venezuelae) 		PF01041
(DegT_DnrJ_EryC1) 		4 HIS A 317
SER A 350
THR A 294
ASP A  14
 None
 1.23A 3tm4A-2ogaA:
2.2		 3tm4A-2ogaA:
23.43
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.
2okx RHAMNOSIDASE B

(Bacillus sp.
GL1) 		PF05592
(Bac_rhamnosid)
PF08531
(Bac_rhamnosid_N)
PF17389
(Bac_rhamnosid6H)
PF17390
(Bac_rhamnosid_C) 		4 HIS A 862
SER A 859
THR A 857
GLU A 572
 GOL  A3007 (-4.1A)
None
None
GOL  A3026 ( 2.9A)
 1.26A 3tm4A-2okxA:
undetectable		 3tm4A-2okxA:
17.15
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.
2ovl PUTATIVE RACEMASE

(Streptomyces
coelicolor) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		4 HIS A 299
THR A 297
GLU A 224
ASP A 229
 None
None
NA  A 400 (-3.3A)
None
 1.42A 3tm4A-2ovlA:
undetectable		 3tm4A-2ovlA:
24.47
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.
2pop MITOGEN-ACTIVATED
PROTEIN KINASE
KINASE KINASE
7-INTERACTING
PROTEIN 1

(Homo sapiens) 		PF00481
(PP2C) 		4 HIS A  47
SER A  46
GLU A  45
ASP A  40
 None
 1.44A 3tm4A-2popA:
undetectable		 3tm4A-2popA:
22.28
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.
2qf9 PUTATIVE SECRETED
PROTEIN

(Streptomyces
coelicolor) 		PF03713
(DUF305) 		4 HIS A 209
THR A 155
GLU A 134
ASP A 132
 None
 1.31A 3tm4A-2qf9A:
undetectable		 3tm4A-2qf9A:
21.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2qlp DEOXYCYTIDINE
TRIPHOSPHATE
DEAMINASE

(Mycobacterium
tuberculosis) 		PF00692
(dUTPase) 		4 HIS A 125
SER A  83
THR A 127
ASP A  23
 None
1PE  A 163 ( 4.6A)
1PE  A 163 ( 4.2A)
None
 1.40A 3tm4A-2qlpA:
undetectable		 3tm4A-2qlpA:
18.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2w2d BOTULINUM NEUROTOXIN
A HEAVY CHAIN

(Clostridium
botulinum) 		PF07952
(Toxin_trans) 		4 SER B 619
THR B 615
GLU B 620
ASP B 650
 GOL  B1874 ( 4.2A)
GOL  B1874 (-4.8A)
None
None
 1.42A 3tm4A-2w2dB:
undetectable		 3tm4A-2w2dB:
22.10
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.
2zbv UNCHARACTERIZED
CONSERVED PROTEIN

(Thermotoga
maritima) 		PF01887
(SAM_adeno_trans) 		4 HIS A  48
SER A  47
THR A  97
ASP A  56
 None
 1.15A 3tm4A-2zbvA:
undetectable		 3tm4A-2zbvA:
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.
3a5r BENZALACETONE
SYNTHASE

(Rheum palmatum) 		PF00195
(Chal_sti_synt_N)
PF02797
(Chal_sti_synt_C) 		4 SER A 379
THR A 353
GLU A 231
ASP A 220
 None
 0.84A 3tm4A-3a5rA:
undetectable		 3tm4A-3a5rA:
25.24
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.
3acp WD REPEAT-CONTAINING
PROTEIN YGL004C

(Saccharomyces
cerevisiae) 		PF00400
(WD40) 		4 SER A 349
THR A 333
GLU A 384
ASP A  95
 None
 1.42A 3tm4A-3acpA:
undetectable		 3tm4A-3acpA:
23.40
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.
3awk CHALCONE
SYNTHASE-LIKE
POLYKETIDE SYNTHASE

(Huperzia
serrata) 		PF00195
(Chal_sti_synt_N)
PF02797
(Chal_sti_synt_C) 		4 SER A 396
THR A 370
GLU A 248
ASP A 237
 None
 0.92A 3tm4A-3awkA:
undetectable		 3tm4A-3awkA:
22.99
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.
3cp8 TRNA URIDINE
5-CARBOXYMETHYLAMINO
METHYL MODIFICATION
ENZYME GIDA

(Chlorobaculum
tepidum) 		PF01134
(GIDA)
PF13932
(GIDA_assoc) 		4 SER A 309
THR A 197
GLU A 277
ASP A 256
 FAD  A 622 ( 4.4A)
None
None
None
 1.29A 3tm4A-3cp8A:
3.4		 3tm4A-3cp8A:
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.
3e2d ALKALINE PHOSPHATASE

(Vibrio sp.
G15-21) 		PF00245
(Alk_phosphatase) 		4 HIS A 316
SER A  65
THR A 118
ASP A 443
 ZN  A 602 ( 3.2A)
ZN  A 602 (-3.5A)
MG  A 603 (-3.0A)
None
 1.21A 3tm4A-3e2dA:
2.0		 3tm4A-3e2dA:
21.63
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3exh PYRUVATE
DEHYDROGENASE E1
COMPONENT SUBUNIT
BETA, MITOCHONDRIAL

(Homo sapiens) 		PF02779
(Transket_pyr)
PF02780
(Transketolase_C) 		4 HIS B 212
SER B 211
GLU B 263
ASP B 299
 None
 1.44A 3tm4A-3exhB:
2.2		 3tm4A-3exhB:
22.52
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.
3gwf CYCLOHEXANONE
MONOOXYGENASE

(Rhodococcus sp.
HI-31) 		PF00743
(FMO-like) 		4 SER A 440
THR A 435
GLU A 442
ASP A  70
 None
 1.22A 3tm4A-3gwfA:
3.4		 3tm4A-3gwfA:
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.
3kqg C-TYPE LECTIN DOMAIN
FAMILY 4 MEMBER K

(Homo sapiens) 		PF00059
(Lectin_C) 		4 SER A 218
THR A 215
GLU A 220
ASP A 269
 SER  A 218 ( 0.0A)
THR  A 215 ( 0.8A)
GLU  A 220 ( 0.6A)
ASP  A 269 ( 0.5A)
 1.34A 3tm4A-3kqgA:
undetectable		 3tm4A-3kqgA:
20.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3l43 DYNAMIN-3

(Homo sapiens) 		PF00350
(Dynamin_N)
PF01031
(Dynamin_M) 		4 HIS A 128
THR A  75
GLU A  79
ASP A  93
 None
 1.28A 3tm4A-3l43A:
undetectable		 3tm4A-3l43A:
24.48
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.
3lg5 EPI-ISOZIZAENE
SYNTHASE

(Streptomyces
coelicolor) 		no annotation 4 HIS A 102
THR A 180
GLU A 253
ASP A 241
 None
None
MG  A 700 ( 4.9A)
None
 1.21A 3tm4A-3lg5A:
undetectable		 3tm4A-3lg5A:
21.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3on5 BH1974 PROTEIN

(Bacillus
halodurans) 		PF02625
(XdhC_CoxI)
PF13478
(XdhC_C) 		4 HIS A  24
SER A  97
THR A  73
GLU A  33
 None
 1.38A 3tm4A-3on5A:
4.4		 3tm4A-3on5A:
22.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ov3 CURCUMIN SYNTHASE

(Curcuma longa) 		PF00195
(Chal_sti_synt_N)
PF02797
(Chal_sti_synt_C) 		4 SER A 386
THR A 360
GLU A 238
ASP A 227
 None
 1.16A 3tm4A-3ov3A:
2.7		 3tm4A-3ov3A:
21.63
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3p54 ENVELOPE
GLYCOPROTEIN

(Japanese
encephalitis
virus) 		PF00869
(Flavi_glycoprot)
PF02832
(Flavi_glycop_C) 		4 HIS A 144
THR A 147
GLU A 373
ASP A 316
 None
 1.28A 3tm4A-3p54A:
undetectable		 3tm4A-3p54A:
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.
3pqd L-LACTATE
DEHYDROGENASE

(Bacillus
subtilis) 		PF00056
(Ldh_1_N)
PF02866
(Ldh_1_C) 		4 HIS A 178
THR A 149
GLU A 182
ASP A 216
 None
 0.96A 3tm4A-3pqdA:
8.1		 3tm4A-3pqdA:
23.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3qt3 PUTATIVE
UNCHARACTERIZED
PROTEIN CPE0426

(Clostridium
perfringens) 		PF06824
(Glyco_hydro_125) 		4 HIS A 350
SER A 348
GLU A 393
ASP A 406
 None
 1.26A 3tm4A-3qt3A:
undetectable		 3tm4A-3qt3A:
23.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3r0o CARNITINYL-COA
DEHYDRATASE

(Mycobacterium
avium) 		PF00378
(ECH_1) 		4 HIS A  89
THR A  41
GLU A  48
ASP A 103
 None
 1.40A 3tm4A-3r0oA:
undetectable		 3tm4A-3r0oA:
22.22
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.
3rx8 CELLULASE

(Alicyclobacillus
acidocaldarius) 		PF00759
(Glyco_hydro_9)
PF02927
(CelD_N) 		4 HIS A 507
SER A 510
THR A 513
ASP A 468
 None
 1.34A 3tm4A-3rx8A:
undetectable		 3tm4A-3rx8A:
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.
3s0m OXALATE
DECARBOXYLASE OXDC

(Bacillus
subtilis) 		PF00190
(Cupin_1) 		4 HIS A  95
THR A 113
GLU A 101
ASP A 156
 MN  A 500 ( 3.3A)
None
MN  A 500 (-2.7A)
None
 1.36A 3tm4A-3s0mA:
undetectable		 3tm4A-3s0mA:
23.10
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.
3sgg HYPOTHETICAL
HYDROLASE

(Bacteroides
thetaiotaomicron) 		PF14323
(GxGYxYP_C)
PF16216
(GxGYxYP_N) 		4 SER A 159
THR A 150
GLU A 200
ASP A 218
 None
 1.43A 3tm4A-3sggA:
undetectable		 3tm4A-3sggA:
21.68
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.
3sqz PUTATIVE
HYDROXYMETHYLGLUTARY
L-COA SYNTHASE

(Streptococcus
mutans) 		PF00195
(Chal_sti_synt_N)
PF08540
(HMG_CoA_synt_C) 		4 SER A 113
THR A 279
GLU A 109
ASP A 181
 None
 1.22A 3tm4A-3sqzA:
undetectable		 3tm4A-3sqzA:
23.01
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.
3sz4 EXONUCLEASE

(Laribacter
hongkongensis) 		PF09588
(YqaJ) 		4 SER A  19
THR A  17
GLU A 112
ASP A 151
 D5M  A 218 (-2.2A)
D5M  A 218 (-3.4A)
MG  A 217 (-3.0A)
None
 1.18A 3tm4A-3sz4A:
undetectable		 3tm4A-3sz4A:
21.93
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3tm5 CRYSTAL STRUCTURE OF
TRM14

(Pyrococcus
furiosus) 		PF01170
(UPF0020)
PF02926
(THUMP) 		5 HIS A 198
SER A 228
THR A 230
GLU A 248
ASP A 276
 SFG  A 401 (-3.8A)
SFG  A 401 (-3.6A)
SFG  A 401 (-3.3A)
SFG  A 401 (-2.6A)
SFG  A 401 (-3.4A)
 0.36A 3tm4A-3tm5A:
54.6		 3tm4A-3tm5A:
100.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3tsy FUSION PROTEIN
4-COUMARATE--COA
LIGASE 1,
RESVERATROL SYNTHASE

(Arabidopsis
thaliana;
Vitis vinifera) 		PF00195
(Chal_sti_synt_N)
PF00501
(AMP-binding)
PF02797
(Chal_sti_synt_C)
PF13193
(AMP-binding_C) 		4 HIS A 972
SER A 973
THR A 947
ASP A 814
 None
 1.13A 3tm4A-3tsyA:
3.1		 3tm4A-3tsyA:
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.
3ubh NEURAL-CADHERIN

(Drosophila
melanogaster) 		PF00028
(Cadherin) 		4 SER A 737
THR A 728
GLU A 731
ASP A 680
 None
 1.29A 3tm4A-3ubhA:
undetectable		 3tm4A-3ubhA:
20.91
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.
3vn4 A DISINTEGRIN AND
METALLOPROTEINASE
WITH THROMBOSPONDIN
MOTIFS 13

(Homo sapiens) 		PF00090
(TSP_1) 		4 SER A 612
THR A 615
GLU A 641
ASP A 672
 None
 1.35A 3tm4A-3vn4A:
undetectable		 3tm4A-3vn4A:
20.05
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.
3vsj 2-AMINO-5-CHLOROPHEN
OL 1,6-DIOXYGENASE
BETA SUBUNIT

(Comamonas
testosteroni) 		PF02900
(LigB) 		4 HIS B  62
SER B  60
THR B 131
GLU B 251
 FE2  B 401 ( 3.4A)
None
None
FE2  B 401 ( 2.5A)
 1.27A 3tm4A-3vsjB:
undetectable		 3tm4A-3vsjB:
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.
3vxm C1-28 TCR BETA CHAIN

(Homo sapiens) 		PF07654
(C1-set)
PF07686
(V-set) 		4 HIS E  29
SER E  94
THR E  96
GLU E 101
 None
 1.31A 3tm4A-3vxmE:
undetectable		 3tm4A-3vxmE:
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.
3wd7 TYPE III POLYKETIDE
SYNTHASES ACRIDONE
SYNTHASE

(Citrus x
microcarpa) 		PF00195
(Chal_sti_synt_N)
PF02797
(Chal_sti_synt_C) 		4 HIS A 385
SER A 386
THR A 360
ASP A 227
 HIS  A 385 ( 1.0A)
SER  A 386 ( 0.0A)
THR  A 360 ( 0.8A)
ASP  A 227 ( 0.6A)
 1.14A 3tm4A-3wd7A:
undetectable		 3tm4A-3wd7A:
24.83
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.
3wst PROTEIN ARGININE
N-METHYLTRANSFERASE
7

(Caenorhabditis
elegans) 		PF13649
(Methyltransf_25) 		4 HIS A 300
THR A 144
GLU A 140
ASP A  70
 None
None
SAH  A 701 (-4.4A)
SAH  A 701 ( 4.4A)
 1.37A 3tm4A-3wstA:
9.1		 3tm4A-3wstA:
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.
4c00 TRANSLOCATION AND
ASSEMBLY MODULE TAMA

(Escherichia
coli) 		PF01103
(Bac_surface_Ag)
PF07244
(POTRA)
PF17243
(POTRA_TamA_1) 		4 SER A 522
THR A 536
GLU A 524
ASP A 528
 MC3  A 603 (-2.6A)
MC3  A 603 (-3.2A)
None
None
 1.09A 3tm4A-4c00A:
undetectable		 3tm4A-4c00A:
22.75
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.
4c4a PROTEIN ARGININE
N-METHYLTRANSFERASE
7

(Mus musculus) 		PF06325
(PrmA) 		4 HIS A 313
THR A 148
GLU A 144
ASP A  70
 None
None
SAH  A1689 (-4.4A)
SAH  A1689 ( 4.4A)
 1.39A 3tm4A-4c4aA:
9.8		 3tm4A-4c4aA:
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.
4d7k SAM-DEPENDENT
METHYLTRANSFERASES

(Streptomyces
davaonensis) 		PF00891
(Methyltransf_2) 		4 SER A  83
THR A  48
GLU A  85
ASP A  91
 None
 1.39A 3tm4A-4d7kA:
14.2		 3tm4A-4d7kA:
23.54
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.
4df3 FIBRILLARIN-LIKE
RRNA/TRNA
2'-O-METHYLTRANSFERA
SE

(Aeropyrum
pernix) 		PF01269
(Fibrillarin) 		4 SER A  88
THR A  90
GLU A 109
ASP A 134
 None
SAM  A 301 (-3.9A)
SAM  A 301 (-2.9A)
SAM  A 301 (-3.3A)
 0.48A 3tm4A-4df3A:
8.1		 3tm4A-4df3A:
21.96
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.
4eys MCCC FAMILY PROTEIN

(Streptococcus
pneumoniae) 		PF02016
(Peptidase_S66) 		4 SER A 176
THR A 178
GLU A  23
ASP A 134
 None
None
AMP  A 401 (-2.9A)
None
 1.20A 3tm4A-4eysA:
undetectable		 3tm4A-4eysA:
22.82
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.
4f9u CG32412

(Drosophila
melanogaster) 		PF04389
(Peptidase_M28) 		4 SER A 181
THR A 177
GLU A 171
ASP A 301
 None
None
ZN  A 401 ( 2.1A)
None
 1.37A 3tm4A-4f9uA:
undetectable		 3tm4A-4f9uA:
20.91
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.
4glk ABIQ

(Lactococcus
lactis) 		PF13958
(ToxN_toxin) 		4 SER A 166
THR A 163
GLU A  99
ASP A  10
 None
 1.36A 3tm4A-4glkA:
undetectable		 3tm4A-4glkA:
20.33
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.
4h3z TRNA
(GUANINE-N(1)-)-METH
YLTRANSFERASE

(Paraburkholderia
phymatum) 		PF01746
(tRNA_m1G_MT) 		4 SER A 136
THR A  97
GLU A 134
ASP A 128
 SAH  A 301 (-3.4A)
None
None
None
 1.22A 3tm4A-4h3zA:
undetectable		 3tm4A-4h3zA:
20.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4h7u PYRANOSE
DEHYDROGENASE

(Leucoagaricus
meleagris) 		PF00732
(GMC_oxred_N)
PF05199
(GMC_oxred_C) 		4 SER A 248
THR A 254
GLU A 273
ASP A  15
 None
 1.36A 3tm4A-4h7uA:
3.3		 3tm4A-4h7uA:
19.94
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.
4ka8 OLIGOPEPTIDASE A

(Arabidopsis
thaliana) 		PF01432
(Peptidase_M3) 		4 HIS A 326
THR A 432
GLU A 440
ASP A 444
 None
 1.24A 3tm4A-4ka8A:
undetectable		 3tm4A-4ka8A:
20.42
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.
4rsi STRUCTURAL
MAINTENANCE OF
CHROMOSOMES PROTEIN
4

(Saccharomyces
cerevisiae) 		PF06470
(SMC_hinge) 		4 HIS B 873
THR B 871
GLU B 877
ASP B 884
 None
 1.27A 3tm4A-4rsiB:
undetectable		 3tm4A-4rsiB:
23.04
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.
4s3j CORTICAL-LYTIC
ENZYME

(Bacillus cereus) 		PF00704
(Glyco_hydro_18)
PF01476
(LysM) 		4 SER A 103
THR A 425
GLU A 105
ASP A 213
 None
 1.33A 3tm4A-4s3jA:
undetectable		 3tm4A-4s3jA:
23.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4u1d EUKARYOTIC
TRANSLATION
INITIATION FACTOR 3
SUBUNIT A

(Saccharomyces
cerevisiae) 		no annotation 4 HIS C 484
THR C 481
GLU C 466
ASP C 464
 None
 1.28A 3tm4A-4u1dC:
undetectable		 3tm4A-4u1dC:
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.
4uer EIF3A

(Lachancea
kluyveri) 		no annotation 4 HIS a 484
THR a 481
GLU a 466
ASP a 464
 None
 1.42A 3tm4A-4uera:
undetectable		 3tm4A-4uera:
16.74
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.
4wzi CAMP-SPECIFIC
3',5'-CYCLIC
PHOSPHODIESTERASE 4B

(Homo sapiens) 		PF00233
(PDEase_I) 		4 SER A 241
THR A 238
GLU A 244
ASP A 281
 None
 1.06A 3tm4A-4wziA:
undetectable		 3tm4A-4wziA:
20.06
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.
4zoh PUTATIVE
OXIDOREDUCTASE
MOLYBDOPTERIN-BINDIN
G SUBUNIT
PUTATIVE
OXIDOREDUCTASE
IRON-SULFUR SUBUNIT

(Sulfurisphaera
tokodaii;
Sulfurisphaera
tokodaii) 		PF01315
(Ald_Xan_dh_C)
PF02738
(Ald_Xan_dh_C2)
PF00111
(Fer2)
PF01799
(Fer2_2) 		4 HIS A 222
THR A 185
GLU A 248
ASP C  48
 None
 1.44A 3tm4A-4zohA:
undetectable		 3tm4A-4zohA:
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.
5ap9 LIPASE

(Thermomyces
lanuginosus) 		PF01764
(Lipase_3)
PF03893
(Lipase3_N) 		4 SER A 217
THR A 186
GLU A 219
ASP A 201
 None
 1.35A 3tm4A-5ap9A:
undetectable		 3tm4A-5ap9A:
20.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5fdn PHOSPHOENOLPYRUVATE
CARBOXYLASE 3

(Arabidopsis
thaliana) 		PF00311
(PEPcase) 		4 HIS A 650
THR A 692
GLU A 697
ASP A 149
 None
 1.20A 3tm4A-5fdnA:
undetectable		 3tm4A-5fdnA:
17.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ful PROTEIN ARGININE
N-METHYLTRANSFERASE
2

(Mus musculus) 		PF05175
(MTS) 		4 HIS A 381
THR A 227
GLU A 223
ASP A 155
 None
None
CA  A1448 (-4.2A)
SAH  A1446 ( 4.5A)
 1.10A 3tm4A-5fulA:
8.8		 3tm4A-5fulA:
19.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5gin FIBRILLARIN-LIKE
RRNA/TRNA
2'-O-METHYLTRANSFERA
SE

(Sulfolobus
solfataricus) 		PF01269
(Fibrillarin) 		4 SER E  87
THR E  89
GLU E 108
ASP E 133
 A  I   6 ( 3.2A)
A  I   6 ( 3.5A)
SAH  E 301 (-3.0A)
SAH  E 301 (-3.5A)
 0.94A 3tm4A-5ginE:
14.5		 3tm4A-5ginE:
21.96
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.
5hfj ADENINE SPECIFIC DNA
METHYLTRANSFERASE
(DPNA)

(Helicobacter
pylori) 		PF01555
(N6_N4_Mtase) 		4 SER A 198
THR A 200
GLU A 216
ASP A   8
 SAM  A 301 (-2.5A)
SAM  A 301 (-3.6A)
SAM  A 301 (-3.1A)
SAM  A 301 (-3.4A)
 0.43A 3tm4A-5hfjA:
undetectable		 3tm4A-5hfjA:
23.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ip9 DNA-DIRECTED RNA
POLYMERASE II
SUBUNIT RPB2

(Saccharomyces
cerevisiae) 		PF00562
(RNA_pol_Rpb2_6)
PF04560
(RNA_pol_Rpb2_7)
PF04561
(RNA_pol_Rpb2_2)
PF04563
(RNA_pol_Rpb2_1)
PF04565
(RNA_pol_Rpb2_3)
PF04566
(RNA_pol_Rpb2_4)
PF04567
(RNA_pol_Rpb2_5) 		4 HIS B 648
THR B 736
GLU B 650
ASP B  29
 None
 1.25A 3tm4A-5ip9B:
undetectable		 3tm4A-5ip9B:
16.19
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.
5m01 PROTEIN
TRAV14-1,T-CELL
RECEPTOR ALPHA CHAIN
C REGION

(Mus musculus) 		no annotation 4 SER G  87
THR G  25
GLU G  22
ASP G 174
 None
 1.42A 3tm4A-5m01G:
undetectable		 3tm4A-5m01G:
18.99
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.
5m10 CYCLOHEXANONE
MONOOXYGENASE FROM
THERMOCRISPUM
MUNICIPALE

(Thermocrispum
municipale) 		PF07992
(Pyr_redox_2) 		4 SER A 440
THR A 435
GLU A 442
ASP A  70
 None
 1.29A 3tm4A-5m10A:
undetectable		 3tm4A-5m10A:
22.64
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.
5mrj BETA-XYLANASE

(Acremonium
chrysogenum) 		no annotation 4 HIS A 116
THR A 123
GLU A 111
ASP A 334
 None
 1.24A 3tm4A-5mrjA:
2.2		 3tm4A-5mrjA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5nd4 TUBULIN ALPHA CHAIN

(Bos taurus) 		PF00091
(Tubulin)
PF03953
(Tubulin_C) 		4 HIS A 107
SER A 151
THR A 190
GLU A 155
 None
 1.25A 3tm4A-5nd4A:
3.9		 3tm4A-5nd4A:
22.76
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.
5nkz PEROXIN 22

(Ogataea angusta) 		no annotation 4 HIS D 114
SER D 111
THR D 108
GLU D 139
 None
 1.40A 3tm4A-5nkzD:
undetectable		 3tm4A-5nkzD:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5o6v ENVELOPE PROTEIN

(Tick-borne
encephalitis
virus) 		no annotation 4 HIS A 146
SER A  40
THR A  34
ASP A  46
 None
 0.97A 3tm4A-5o6vA:
undetectable		 3tm4A-5o6vA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5tch TRYPTOPHAN SYNTHASE
BETA CHAIN

(Mycobacterium
tuberculosis) 		PF00291
(PALP) 		4 HIS B 100
SER B  99
THR B  97
ASP B 319
 LLP  B 101 ( 3.5A)
LLP  B 101 ( 2.9A)
None
None
 1.43A 3tm4A-5tchB:
2.5		 3tm4A-5tchB:
22.84
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.
5uc5 CHS2 CHALCONE
SYNTHASE

(Malus domestica) 		no annotation 4 SER A 386
THR A 360
GLU A 238
ASP A 227
 None
 0.98A 3tm4A-5uc5A:
2.6		 3tm4A-5uc5A:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5v1w GLYCOSIDE HYDROLASE

(Bacillus
halodurans) 		PF03639
(Glyco_hydro_81) 		4 HIS A 315
SER A 579
THR A 576
ASP A 725
 PO4  A 808 (-3.8A)
PO4  A 808 (-4.9A)
None
None
 1.02A 3tm4A-5v1wA:
undetectable		 3tm4A-5v1wA:
19.19
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.
6aqo HYPOXANTHINE-GUANINE
PHOSPHORIBOSYLTRANSF
ERASE

(Trypanosoma
brucei) 		no annotation 4 SER A  84
THR A  93
GLU A 147
ASP A 151
 None
None
None
45T  A 301 (-4.1A)
 1.27A 3tm4A-6aqoA:
2.0		 3tm4A-6aqoA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6co0 STYRYLPYRONE
SYNTHASE 1

(Piper
methysticum) 		no annotation 4 HIS A 386
SER A 387
THR A 361
ASP A 228
 None
 1.36A 3tm4A-6co0A:
undetectable		 3tm4A-6co0A:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6cqb CHALCONE SYNTHASE

(Piper
methysticum) 		no annotation 4 HIS A 386
SER A 387
THR A 361
ASP A 228
 None
 1.03A 3tm4A-6cqbA:
3.1		 3tm4A-6cqbA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6f0k FE-S-CLUSTER-CONTAIN
ING HYDROGENASE

(Rhodothermus
marinus) 		no annotation 4 HIS B 652
SER B 610
THR B 613
ASP B 604
 None
 1.41A 3tm4A-6f0kB:
undetectable		 3tm4A-6f0kB:
undetectable