SIMILAR PATTERNS OF AMINO ACIDS FOR 3TKA_A_SAMA400_0

List of similar pattern of amino acids derived from ASSAM search

Hit pattern: 3D amino acid arrangements similar to known drug binding site
Query pattern: Residues from known binding site for annotated drug that match the hit pattern

(Click link on the last column to view superposed patterns of amino acids in NGL viewer)
(Note that only 3-12 residue patterns can be used for ASSAM searches)
Filter list by:
Hit Macromolecule/
Organism		 Pfam Res. Interface HETATM RMSD Dali Z-score Seq. Identity (%) View Dock
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1bg6 N-(1-D-CARBOXYLETHYL
)-L-NORVALINE
DEHYDROGENASE

(Arthrobacter
sp. 1C) 		PF02317
(Octopine_DH)
PF02558
(ApbA) 		5 GLY A 114
HIS A  88
PHE A  19
SER A 136
MET A 159
 None
 1.32A 3tkaA-1bg6A:
5.6		 3tkaA-1bg6A:
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.
1i6q LACTOFERRIN

(Camelus
dromedarius) 		PF00405
(Transferrin) 		5 GLY A 525
GLY A 466
HIS A 458
ARG A 522
GLU A 510
 None
 1.34A 3tkaA-1i6qA:
undetectable		 3tkaA-1i6qA:
20.29
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1m6y S-ADENOSYL-METHYLTRA
NSFERASE MRAW

(Thermotoga
maritima) 		PF01795
(Methyltransf_5) 		7 THR A  32
GLY A  34
GLY A  37
HIS A  38
ASP A  57
SER A 107
MET A 130
 SAH  A 401 (-3.9A)
SAH  A 401 (-3.5A)
SAH  A 401 (-3.3A)
SAH  A 401 (-4.0A)
None
None
SAH  A 401 (-3.6A)
 0.65A 3tkaA-1m6yA:
34.0		 3tkaA-1m6yA:
39.72
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1m6y S-ADENOSYL-METHYLTRA
NSFERASE MRAW

(Thermotoga
maritima) 		PF01795
(Methyltransf_5) 		7 THR A  32
GLY A  34
HIS A  38
ASP A  57
SER A 107
GLN A 110
MET A 130
 SAH  A 401 (-3.9A)
SAH  A 401 (-3.5A)
SAH  A 401 (-4.0A)
None
None
SAH  A 401 (-3.3A)
SAH  A 401 (-3.6A)
 0.67A 3tkaA-1m6yA:
34.0		 3tkaA-1m6yA:
39.72
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.
1nsv GALACTOSE MUTAROTASE

(Lactococcus
lactis) 		PF01263
(Aldose_epim) 		5 THR A 163
GLY A 135
GLY A 132
ASP A 160
GLU A 326
 None
 1.23A 3tkaA-1nsvA:
undetectable		 3tkaA-1nsvA:
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.
1o4z BETA-AGARASE B

(Zobellia
galactanivorans) 		PF00722
(Glyco_hydro_16) 		5 THR A 169
GLY A 192
ASP A 194
SER A 207
GLU A 197
 None
 1.37A 3tkaA-1o4zA:
undetectable		 3tkaA-1o4zA:
20.10
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.
1ope SUCCINYL-COA:3-KETOA
CID-COENZYME A
TRANSFERASE

(Sus scrofa) 		PF01144
(CoA_trans) 		5 THR A 422
GLY A 121
GLY A 123
ASP A 389
SER A 392
 None
 1.40A 3tkaA-1opeA:
undetectable		 3tkaA-1opeA:
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.
1u5q SERINE/THREONINE
PROTEIN KINASE TAO2

(Rattus
norvegicus) 		PF00069
(Pkinase) 		5 THR A 132
GLY A 134
GLY A 138
PHE A 280
GLU A 125
 None
 1.37A 3tkaA-1u5qA:
undetectable		 3tkaA-1u5qA:
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.
1u6z EXOPOLYPHOSPHATASE

(Escherichia
coli) 		PF02541
(Ppx-GppA) 		5 THR A  89
GLY A  19
GLY A 146
HIS A  90
GLU A 114
 SO4  A 701 (-4.3A)
SO4  A 701 (-3.4A)
SO4  A 701 (-3.4A)
None
None
 1.37A 3tkaA-1u6zA:
undetectable		 3tkaA-1u6zA:
22.47
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.
1vgm 378AA LONG
HYPOTHETICAL CITRATE
SYNTHASE

(Sulfurisphaera
tokodaii) 		PF00285
(Citrate_synt) 		5 THR A 313
GLY A 256
GLY A 258
HIS A 259
PHE A 272
 None
 1.05A 3tkaA-1vgmA:
undetectable		 3tkaA-1vgmA:
22.93
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1wg8 PREDICTED
S-ADENOSYLMETHIONINE
-DEPENDENT
METHYLTRANSFERASE

(Thermus
thermophilus) 		PF01795
(Methyltransf_5) 		8 THR A  30
GLY A  32
GLY A  35
HIS A  36
ASP A  53
PHE A  75
SER A 100
MET A 123
 SAM  A3142 (-3.8A)
SAM  A3142 (-3.4A)
SAM  A3142 (-3.1A)
SAM  A3142 (-3.9A)
None
SAM  A3142 (-3.2A)
SAM  A3142 (-4.1A)
SAM  A3142 (-3.5A)
 0.60A 3tkaA-1wg8A:
37.7		 3tkaA-1wg8A:
41.13
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.
1y79 PEPTIDYL-DIPEPTIDASE
DCP

(Escherichia
coli) 		PF01432
(Peptidase_M3) 		5 GLY 1 477
HIS 1 473
ARG 1 649
SER 1 488
GLN 1 482
 None
ZN  1 700 ( 3.3A)
None
None
None
 1.33A 3tkaA-1y791:
undetectable		 3tkaA-1y791:
19.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2avn UBIQUINONE/MENAQUINO
NE BIOSYNTHESIS
METHYLTRANSFERASE-RE
LATED PROTEIN

(Thermotoga
maritima) 		PF08241
(Methyltransf_11) 		5 THR A  53
GLY A  51
GLY A 110
SER A  57
GLU A  82
 None
SAI  A1300 (-3.8A)
SAI  A1300 (-3.4A)
None
None
 0.97A 3tkaA-2avnA:
12.0		 3tkaA-2avnA:
23.26
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.
2bht CYSTEINE SYNTHASE B

(Escherichia
coli) 		PF00291
(PALP) 		5 THR A 153
GLY A 155
GLY A 181
HIS A 150
GLN A 161
 None
 1.35A 3tkaA-2bhtA:
2.5		 3tkaA-2bhtA:
23.37
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.
2fpg SUCCINYL-COA LIGASE
[GDP-FORMING]
ALPHA-CHAIN,
MITOCHONDRIAL

(Sus scrofa) 		PF00549
(Ligase_CoA)
PF02629
(CoA_binding) 		5 GLY A 129
ARG A 161
ASP A 189
PHE A 196
GLU A 223
 None
 1.22A 3tkaA-2fpgA:
2.7		 3tkaA-2fpgA:
20.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2h88 SUCCINATE
DEHYDROGENASE
FLAVOPROTEIN SUBUNIT

(Gallus gallus) 		PF00890
(FAD_binding_2)
PF02910
(Succ_DH_flav_C) 		5 GLY A  86
ARG A 619
GLY A 405
HIS A 404
SER A 296
 None
 1.35A 3tkaA-2h88A:
undetectable		 3tkaA-2h88A:
20.64
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.
2h92 CYTIDYLATE KINASE

(Staphylococcus
aureus) 		PF02224
(Cytidylate_kin) 		5 GLY A  15
GLY A  10
ARG A  22
SER A  17
GLU A  26
 SO4  A1400 (-3.6A)
None
None
SO4  A1400 (-3.1A)
None
 1.30A 3tkaA-2h92A:
undetectable		 3tkaA-2h92A:
20.68
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.
2i0k OXIDOREDUCTASE

(Brevibacterium
sterolicum) 		PF01565
(FAD_binding_4)
PF09129
(Chol_subst-bind) 		5 THR A 500
GLY A 480
GLY A 203
HIS A 202
ASP A 510
 None
None
None
FAD  A 700 (-3.9A)
None
 1.25A 3tkaA-2i0kA:
undetectable		 3tkaA-2i0kA:
20.21
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.
2i1y RECEPTOR-TYPE
TYROSINE-PROTEIN
PHOSPHATASE

(Homo sapiens) 		PF00102
(Y_phosphatase) 		5 GLY A 785
ARG A 739
GLY A 912
ARG A 822
ASP A 821
 None
 1.14A 3tkaA-2i1yA:
undetectable		 3tkaA-2i1yA:
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.
2k5r UNCHARACTERIZED
PROTEIN XF2673

(Xylella
fastidiosa) 		PF03966
(Trm112p) 		5 ARG A  59
ASP A  58
PHE A  86
GLN A  16
GLU A  22
 None
 1.34A 3tkaA-2k5rA:
undetectable		 3tkaA-2k5rA:
13.83
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.
2obv S-ADENOSYLMETHIONINE
SYNTHETASE ISOFORM
TYPE-1

(Homo sapiens) 		PF00438
(S-AdoMet_synt_N)
PF02772
(S-AdoMet_synt_M)
PF02773
(S-AdoMet_synt_C) 		5 THR A 288
GLY A 133
GLY A 323
ARG A 292
ASP A 291
 None
 1.41A 3tkaA-2obvA:
undetectable		 3tkaA-2obvA:
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.
2qvs CAMP-DEPENDENT
PROTEIN KINASE TYPE
II-ALPHA REGULATORY
SUBUNIT

(Mus musculus) 		PF00027
(cNMP_binding) 		5 GLY B 349
GLY B 300
ARG B 283
SER B 303
GLU B 289
 GLY  B 349 ( 0.0A)
GLY  B 300 ( 0.0A)
ARG  B 283 ( 0.6A)
SER  B 303 ( 0.0A)
GLU  B 289 ( 0.6A)
 1.38A 3tkaA-2qvsB:
undetectable		 3tkaA-2qvsB:
21.95
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.
2r26 CITRATE SYNTHASE

(Thermoplasma
acidophilum) 		PF00285
(Citrate_synt) 		5 THR A 316
GLY A 259
GLY A 261
HIS A 262
PHE A 275
 OAA  A 501 ( 4.9A)
CMC  A 701 (-3.3A)
CMC  A 701 (-3.2A)
OAA  A 501 ( 4.0A)
None
 1.04A 3tkaA-2r26A:
undetectable		 3tkaA-2r26A:
21.45
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.
2wbe BIPOLAR KINESIN
KRP-130

(Drosophila
melanogaster) 		PF00225
(Kinesin) 		5 THR C  98
GLY C  96
ARG C  15
GLY C  91
GLU C 108
 MG  C1359 ( 3.2A)
ANP  C1358 (-3.0A)
None
None
None
 1.37A 3tkaA-2wbeC:
undetectable		 3tkaA-2wbeC:
23.15
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.
2xvg ALPHA XYLOSIDASE

(Cellvibrio
japonicus) 		PF01055
(Glyco_hydro_31)
PF16338
(DUF4968)
PF17137
(DUF5110) 		5 GLY A 741
GLY A 690
ARG A 443
ASP A 470
SER A 440
 None
 1.19A 3tkaA-2xvgA:
undetectable		 3tkaA-2xvgA:
16.06
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.
2y24 XYLANASE

(Dickeya
chrysanthemi) 		PF02055
(Glyco_hydro_30)
PF17189
(Glyco_hydro_30C) 		5 ARG A 307
GLY A 272
ASP A 257
SER A 267
GLN A 260
 None
 1.37A 3tkaA-2y24A:
undetectable		 3tkaA-2y24A:
19.95
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3cih PUTATIVE
ALPHA-RHAMNOSIDASE

(Bacteroides
thetaiotaomicron) 		PF17389
(Bac_rhamnosid6H)
PF17390
(Bac_rhamnosid_C) 		5 THR A 386
GLY A 371
PHE A 387
SER A 377
GLU A 456
 None
 1.34A 3tkaA-3cihA:
undetectable		 3tkaA-3cihA:
17.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ck2 CONSERVED
UNCHARACTERIZED
PROTEIN (PREDICTED
PHOSPHOESTERASE
COG0622)

(Streptococcus
pneumoniae) 		PF12850
(Metallophos_2) 		5 GLY A  37
GLY A 109
HIS A 110
PHE A  60
SER A  12
 None
None
MN  A 202 ( 3.5A)
None
None
 1.25A 3tkaA-3ck2A:
undetectable		 3tkaA-3ck2A:
19.03
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.
3dty OXIDOREDUCTASE,
GFO/IDH/MOCA FAMILY

(Pseudomonas
syringae group
genomosp. 3) 		PF01408
(GFO_IDH_MocA)
PF02894
(GFO_IDH_MocA_C) 		5 GLY A 270
HIS A 269
ARG A 306
GLN A 291
GLU A 327
 None
 1.37A 3tkaA-3dtyA:
5.0		 3tkaA-3dtyA:
24.76
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.
3ek5 URIDYLATE KINASE

(Xanthomonas
campestris) 		PF00696
(AA_kinase) 		5 GLY A 233
ARG A 180
GLY A 216
ASP A 182
GLN A 231
 None
 1.17A 3tkaA-3ek5A:
3.6		 3tkaA-3ek5A:
23.32
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.
3euf URIDINE
PHOSPHORYLASE 1

(Homo sapiens) 		PF01048
(PNP_UDP_1) 		5 GLY A 140
GLY A  60
ARG A 294
SER A 142
GLU A 290
 PO4  A 401 (-3.3A)
PO4  A 401 (-3.4A)
None
None
None
 0.94A 3tkaA-3eufA:
undetectable		 3tkaA-3eufA:
24.68
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.
3fca CYSTEINE SYNTHASE

(Thermus
thermophilus) 		PF00291
(PALP) 		5 THR A 145
GLY A 147
GLY A 173
HIS A 142
GLN A 153
 None
 1.23A 3tkaA-3fcaA:
2.2		 3tkaA-3fcaA:
21.41
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.
3fed GLUTAMATE
CARBOXYPEPTIDASE III

(Homo sapiens) 		PF02225
(PA)
PF04253
(TFR_dimer)
PF04389
(Peptidase_M28) 		6 THR A 379
GLY A 381
GLY A 366
HIS A 367
SER A 445
GLN A 563
 None
None
None
ZN  A1752 ( 3.3A)
None
None
 1.14A 3tkaA-3fedA:
undetectable		 3tkaA-3fedA:
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.
3h4p PROTEASOME SUBUNIT
ALPHA

(Methanocaldococcus
jannaschii) 		PF00227
(Proteasome)
PF10584
(Proteasome_A_N) 		5 THR A  79
GLY A  81
GLY A 167
ASP A  85
PHE A  69
 None
 1.19A 3tkaA-3h4pA:
undetectable		 3tkaA-3h4pA:
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.
3hkm OS03G0854200 PROTEIN

(Oryza sativa) 		PF01138
(RNase_PH) 		5 THR A 199
GLY A 142
HIS A 168
ASP A 207
SER A 165
 None
 1.25A 3tkaA-3hkmA:
undetectable		 3tkaA-3hkmA:
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.
3hmu AMINOTRANSFERASE,
CLASS III

(Ruegeria
pomeroyi) 		PF00202
(Aminotran_3) 		5 GLY A 235
GLY A 420
HIS A 418
ARG A 269
SER A 381
 None
 1.38A 3tkaA-3hmuA:
undetectable		 3tkaA-3hmuA:
23.65
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.
3ita D-ALANYL-D-ALANINE
CARBOXYPEPTIDASE
DACC

(Escherichia
coli) 		PF00768
(Peptidase_S11)
PF07943
(PBP5_C) 		5 THR A 263
GLY A 292
ARG A 340
GLY A 289
SER A  23
 None
 1.20A 3tkaA-3itaA:
undetectable		 3tkaA-3itaA:
22.94
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.
3k70 EXODEOXYRIBONUCLEASE
V ALPHA CHAIN

(Escherichia
coli) 		PF13538
(UvrD_C_2)
PF13604
(AAA_30) 		5 GLY D  47
ARG D  17
HIS D  50
ARG D 111
SER D  43
 None
 1.38A 3tkaA-3k70D:
undetectable		 3tkaA-3k70D:
21.95
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.
3opy 6-PHOSPHOFRUCTO-1-KI
NASE BETA-SUBUNIT

(Komagataella
pastoris) 		PF00365
(PFK) 		5 GLY B 287
GLY B 284
ARG B 294
GLN B 524
GLU B 298
 None
 1.30A 3tkaA-3opyB:
undetectable		 3tkaA-3opyB:
17.07
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.
3p0f URIDINE
PHOSPHORYLASE 2

(Homo sapiens) 		PF01048
(PNP_UDP_1) 		5 GLY A 146
GLY A  66
ARG A 300
SER A 148
GLU A 296
 None
 0.94A 3tkaA-3p0fA:
undetectable		 3tkaA-3p0fA:
22.31
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.
3pih UVRABC SYSTEM
PROTEIN A

(Thermotoga
maritima) 		PF00005
(ABC_tran) 		5 THR A 285
GLY A 283
ARG A 391
GLY A 388
GLU A 375
 None
 1.20A 3tkaA-3pihA:
undetectable		 3tkaA-3pihA:
17.70
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.
3q58 N-ACETYLMANNOSAMINE-
6-PHOSPHATE
2-EPIMERASE

(Salmonella
enterica) 		PF04131
(NanE) 		5 THR A 153
GLY A 185
GLY A 207
MET A 170
GLU A 138
 None
PEG  A 231 ( 4.0A)
None
None
None
 1.17A 3tkaA-3q58A:
undetectable		 3tkaA-3q58A:
22.90
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.
3r0s ACYL-[ACYL-CARRIER-P
ROTEIN]--UDP-N-ACETY
LGLUCOSAMINE
O-ACYLTRANSFERASE

(Campylobacter
jejuni) 		PF00132
(Hexapep)
PF13720
(Acetyltransf_11) 		5 GLY A 198
ARG A 210
ASP A 209
SER A 212
GLU A 236
 None
 1.21A 3tkaA-3r0sA:
undetectable		 3tkaA-3r0sA:
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.
3r5b TETRAHYDRODIPICOLINA
TE
N-SUCCINYLETRANSFERA
SE

(Pseudomonas
aeruginosa) 		PF14602
(Hexapep_2)
PF14789
(THDPS_M)
PF14790
(THDPS_N) 		5 GLY A 239
ARG A 223
GLY A 206
SER A 241
GLU A 279
 None
 1.39A 3tkaA-3r5bA:
undetectable		 3tkaA-3r5bA:
23.39
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.
3r7k PROBABLE ACYL COA
DEHYDROGENASE

(Mycobacteroides
abscessus) 		PF00441
(Acyl-CoA_dh_1)
PF02770
(Acyl-CoA_dh_M)
PF02771
(Acyl-CoA_dh_N) 		5 THR A 229
ARG A 225
ARG A 217
ASP A 220
GLU A 231
 FDA  A 420 ( 4.4A)
None
None
None
None
 1.42A 3tkaA-3r7kA:
undetectable		 3tkaA-3r7kA:
23.52
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.
3r7k PROBABLE ACYL COA
DEHYDROGENASE

(Mycobacteroides
abscessus) 		PF00441
(Acyl-CoA_dh_1)
PF02770
(Acyl-CoA_dh_M)
PF02771
(Acyl-CoA_dh_N) 		5 THR A 229
ARG A 225
GLY A 104
ASP A 220
GLU A 231
 FDA  A 420 ( 4.4A)
None
None
None
None
 1.38A 3tkaA-3r7kA:
undetectable		 3tkaA-3r7kA:
23.52
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.
3s6k ACETYLGLUTAMATE
KINASE

(Xanthomonas
campestris) 		PF00696
(AA_kinase)
PF04768
(NAT) 		5 GLY A  50
GLY A  79
HIS A  78
ASP A  55
GLU A  58
 None
 1.37A 3tkaA-3s6kA:
3.0		 3tkaA-3s6kA:
25.57
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.
3sil SIALIDASE

(Salmonella
enterica) 		PF13859
(BNR_3) 		5 THR A  33
GLY A  28
GLY A  30
HIS A  15
ARG A  56
 None
 1.27A 3tkaA-3silA:
undetectable		 3tkaA-3silA:
20.81
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.
3tat TYROSINE
AMINOTRANSFERASE

(Escherichia
coli) 		PF00155
(Aminotran_1_2) 		5 GLY A 281
ARG A 282
GLY A 285
ARG A  99
ASP A 276
 None
 1.30A 3tkaA-3tatA:
4.2		 3tkaA-3tatA:
24.37
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.
3tbh O-ACETYL SERINE
SULFHYDRYLASE

(Leishmania
donovani) 		PF00291
(PALP) 		5 THR A 165
GLY A 167
GLY A 193
HIS A 162
GLN A 173
 None
 1.26A 3tkaA-3tbhA:
2.6		 3tkaA-3tbhA:
22.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3tcm ALANINE
AMINOTRANSFERASE 2

(Hordeum vulgare) 		PF00155
(Aminotran_1_2) 		5 GLY A 147
ARG A 308
GLY A 339
SER A 298
GLU A 259
 DCS  A 501 (-3.5A)
DCS  A 501 (-3.5A)
None
DCS  A 501 (-2.9A)
None
 1.33A 3tkaA-3tcmA:
6.1		 3tkaA-3tcmA:
21.89
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3tka RIBOSOMAL RNA SMALL
SUBUNIT
METHYLTRANSFERASE H

(Escherichia
coli) 		PF01795
(Methyltransf_5) 		12 THR A  31
GLY A  33
ARG A  34
GLY A  36
HIS A  37
ARG A  56
ASP A  57
PHE A  79
SER A 105
GLN A 108
MET A 128
GLU A 218
 SAM  A 400 (-3.9A)
SAM  A 400 (-3.4A)
None
SAM  A 400 (-3.1A)
SAM  A 400 (-3.8A)
SAM  A 400 (-4.8A)
None
SAM  A 400 (-3.2A)
SAM  A 400 (-4.0A)
SAM  A 400 (-3.4A)
SAM  A 400 (-3.3A)
SAM  A 400 (-3.8A)
 0.00A 3tkaA-3tkaA:
49.4		 3tkaA-3tkaA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3tka RIBOSOMAL RNA SMALL
SUBUNIT
METHYLTRANSFERASE H

(Escherichia
coli) 		PF01795
(Methyltransf_5) 		7 THR A  31
GLY A  35
PHE A  79
SER A 105
GLN A 108
MET A 128
GLU A 218
 SAM  A 400 (-3.9A)
SAM  A 400 (-4.3A)
SAM  A 400 (-3.2A)
SAM  A 400 (-4.0A)
SAM  A 400 (-3.4A)
SAM  A 400 (-3.3A)
SAM  A 400 (-3.8A)
 0.84A 3tkaA-3tkaA:
49.4		 3tkaA-3tkaA:
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.
3vvc CAPSULAR
POLYSACCHARIDE
SYNTHESIS ENZYME
CAP8E

(Staphylococcus
aureus) 		PF02719
(Polysacc_synt_2)
PF08485
(Polysacc_syn_2C) 		5 GLY A  12
HIS A  79
SER A  36
GLN A  42
GLU A  31
 None
None
NAP  A 401 (-2.4A)
None
None
 1.41A 3tkaA-3vvcA:
8.1		 3tkaA-3vvcA:
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.
3wsv L-LACTATE
DEHYDROGENASE

(Enterococcus
mundtii) 		PF00056
(Ldh_1_N)
PF02866
(Ldh_1_C) 		5 THR A 240
GLY A 237
GLY A  17
ARG A 242
GLN A  27
 None
 1.29A 3tkaA-3wsvA:
4.9		 3tkaA-3wsvA:
23.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4at0 3-KETOSTEROID-DELTA4
-5ALPHA-DEHYDROGENAS
E

(Rhodococcus
jostii) 		PF00890
(FAD_binding_2) 		5 THR A 470
GLY A 473
GLY A 455
ARG A 164
GLU A 150
 None
None
FAD  A1493 (-3.5A)
None
None
 1.30A 3tkaA-4at0A:
undetectable		 3tkaA-4at0A:
24.62
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.
4atf BETA-AGARASE B

(Zobellia
galactanivorans) 		PF00722
(Glyco_hydro_16) 		5 THR A 169
GLY A 192
ASP A 194
SER A 207
GLU A 197
 None
 1.36A 3tkaA-4atfA:
undetectable		 3tkaA-4atfA:
21.95
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.
4b2o YMDB
PHOSPHODIESTERASE

(Bacillus
subtilis) 		PF13277
(YmdB) 		5 THR A 199
GLY A 200
GLY A 207
HIS A 177
ASP A  16
 None
None
None
FE2  A1266 ( 3.3A)
None
 1.38A 3tkaA-4b2oA:
undetectable		 3tkaA-4b2oA:
23.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4bc7 ALKYLDIHYDROXYACETON
EPHOSPHATE SYNTHASE,
PEROXISOMAL

(Cavia porcellus) 		PF01565
(FAD_binding_4)
PF02913
(FAD-oxidase_C) 		5 THR A 283
GLY A 281
GLY A 311
SER A 261
GLN A 262
 None
None
FAD  A 999 (-3.4A)
None
None
 1.26A 3tkaA-4bc7A:
undetectable		 3tkaA-4bc7A:
18.66
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.
4bc7 ALKYLDIHYDROXYACETON
EPHOSPHATE SYNTHASE,
PEROXISOMAL

(Cavia porcellus) 		PF01565
(FAD_binding_4)
PF02913
(FAD-oxidase_C) 		5 THR A 283
GLY A 281
GLY A 312
SER A 261
GLN A 262
 None
None
FAD  A 999 (-3.5A)
None
None
 1.23A 3tkaA-4bc7A:
undetectable		 3tkaA-4bc7A:
18.66
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.
4e79 UDP-3-O-ACYLGLUCOSAM
INE
N-ACYLTRANSFERASE

(Acinetobacter
baumannii) 		PF00132
(Hexapep)
PF04613
(LpxD)
PF14602
(Hexapep_2) 		5 THR A 228
GLY A 223
GLY A 187
ASP A 226
GLU A 231
 None
 1.39A 3tkaA-4e79A:
undetectable		 3tkaA-4e79A:
23.66
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.
4fys AMINOPEPTIDASE N

(Homo sapiens) 		PF01433
(Peptidase_M1)
PF11838
(ERAP1_C) 		5 GLY A 412
ARG A 485
ASP A 439
SER A 415
MET A 435
 None
 1.33A 3tkaA-4fysA:
undetectable		 3tkaA-4fysA:
15.93
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.
4fys AMINOPEPTIDASE N

(Homo sapiens) 		PF01433
(Peptidase_M1)
PF11838
(ERAP1_C) 		5 GLY A 480
ARG A 485
ASP A 439
SER A 415
MET A 435
 None
 1.19A 3tkaA-4fysA:
undetectable		 3tkaA-4fysA:
15.93
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.
4g9i HYDROGENASE
MATURATION PROTEIN
HYPF

(Thermococcus
kodakarensis) 		PF00708
(Acylphosphatase)
PF00814
(Peptidase_M22)
PF01300
(Sua5_yciO_yrdC)
PF07503
(zf-HYPF) 		5 THR A 243
GLY A 334
ARG A 242
ASP A 350
GLU A 238
 None
 1.16A 3tkaA-4g9iA:
undetectable		 3tkaA-4g9iA:
17.63
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.
4itk APOFERREDOXIN

(Chlamydomonas
reinhardtii) 		PF00111
(Fer2) 		5 THR A  75
GLY A  48
GLY A  71
ASP A  89
GLU A  28
 None
None
GOL  A 202 (-3.2A)
None
None
 1.35A 3tkaA-4itkA:
undetectable		 3tkaA-4itkA:
14.91
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.
4j2o UDP-N-ACETYLGLUCOSAM
INE
4,6-DEHYDRATASE/5-EP
IMERASE

(Acinetobacter
baumannii) 		PF02719
(Polysacc_synt_2)
PF08485
(Polysacc_syn_2C) 		5 GLY A  11
HIS A  79
SER A  36
GLN A  42
GLU A  31
 NAP  A 400 (-3.3A)
None
NAP  A 400 (-3.0A)
None
None
 1.33A 3tkaA-4j2oA:
9.6		 3tkaA-4j2oA:
26.25
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.
4j2o UDP-N-ACETYLGLUCOSAM
INE
4,6-DEHYDRATASE/5-EP
IMERASE

(Acinetobacter
baumannii) 		PF02719
(Polysacc_synt_2)
PF08485
(Polysacc_syn_2C) 		5 GLY A  12
HIS A  79
SER A  36
GLN A  42
GLU A  31
 None
None
NAP  A 400 (-3.0A)
None
None
 1.31A 3tkaA-4j2oA:
9.6		 3tkaA-4j2oA:
26.25
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.
4kry ACETYL ESTERASE

(Escherichia
coli) 		PF07859
(Abhydrolase_3) 		5 GLY A 196
GLY A 163
ARG A 269
ASP A 267
PHE A 284
 SEB  A 165 ( 3.5A)
None
None
PGE  A 401 ( 4.4A)
None
 1.31A 3tkaA-4kryA:
3.0		 3tkaA-4kryA:
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.
4kto ISOVALERYL-COA
DEHYDROGENASE

(Sinorhizobium
meliloti) 		PF00441
(Acyl-CoA_dh_1)
PF02770
(Acyl-CoA_dh_M)
PF02771
(Acyl-CoA_dh_N) 		5 GLY A  89
GLY A 254
PHE A  24
SER A  91
GLU A  49
 None
 1.28A 3tkaA-4ktoA:
undetectable		 3tkaA-4ktoA:
25.34
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.
4l8k PUTATIVE PEPTIDASE

(Parabacteroides
merdae) 		PF03572
(Peptidase_S41)
PF14684
(Tricorn_C1) 		5 GLY A 176
GLY A 178
ASP A 174
SER A 239
GLU A 103
 None
 1.29A 3tkaA-4l8kA:
undetectable		 3tkaA-4l8kA:
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.
4lcm TRANSESTERASE

(Aspergillus
terreus) 		PF00144
(Beta-lactamase) 		5 THR A 141
GLY A 143
GLY A 189
HIS A 140
ASP A 181
 None
 1.13A 3tkaA-4lcmA:
undetectable		 3tkaA-4lcmA:
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.
4lql L-ARABINOSE
ISOMERASE

(Lactobacillus
fermentum) 		PF02610
(Arabinose_Isome)
PF11762
(Arabinose_Iso_C) 		5 GLY A 307
ARG A 180
GLY A 304
ARG A 186
ASP A 183
 None
 1.19A 3tkaA-4lqlA:
undetectable		 3tkaA-4lqlA:
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.
4mh1 SORBOSE
DEHYDROGENASE

(Ketogulonicigenium
vulgare) 		PF13360
(PQQ_2) 		5 THR A 448
GLY A 314
ARG A 343
MET A 329
GLU A 302
 None
 1.35A 3tkaA-4mh1A:
undetectable		 3tkaA-4mh1A:
22.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4o5m ISOVALERYL-COA
DEHYDROGENASE

(Brucella suis) 		PF00441
(Acyl-CoA_dh_1)
PF02770
(Acyl-CoA_dh_M)
PF02771
(Acyl-CoA_dh_N) 		5 GLY A  84
GLY A 249
PHE A  19
SER A  86
GLU A  44
 None
 1.27A 3tkaA-4o5mA:
undetectable		 3tkaA-4o5mA:
22.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4oxi ENTEROBACTIN
SYNTHETASE COMPONENT
F-RELATED PROTEIN

(Vibrio cholerae) 		PF00501
(AMP-binding) 		5 THR A 350
GLY A 341
GLY A 317
GLN A 403
GLU A 371
 None
GAP  A 601 (-4.9A)
GAP  A 601 (-3.2A)
None
None
 1.38A 3tkaA-4oxiA:
undetectable		 3tkaA-4oxiA:
20.24
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.
4ry9 PERIPLASMIC BINDING
PROTEIN/LACI
TRANSCRIPTIONAL
REGULATOR

(Verminephrobacter
eiseniae) 		PF13407
(Peripla_BP_4) 		5 ARG A 177
GLY A 144
ASP A 260
PHE A 323
SER A 138
 TLZ  A 401 (-2.9A)
None
TLZ  A 401 ( 2.7A)
GOL  A 406 (-4.8A)
None
 1.10A 3tkaA-4ry9A:
3.9		 3tkaA-4ry9A:
24.06
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.
4rzk SMALL HEAT SHOCK
PROTEIN HSP20 FAMILY

(Sulfolobus
solfataricus) 		PF00011
(HSP20) 		5 GLY A 104
GLY A 154
ASP A 129
SER A 127
GLU A  81
 None
 1.02A 3tkaA-4rzkA:
undetectable		 3tkaA-4rzkA:
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.
4tmu RECQ

(Cronobacter
sakazakii) 		PF00270
(DEAD)
PF00271
(Helicase_C)
PF09382
(RQC)
PF16124
(RecQ_Zn_bind) 		5 GLY A  52
GLY A  50
PHE A  26
SER A  54
GLN A  58
 None
 1.41A 3tkaA-4tmuA:
undetectable		 3tkaA-4tmuA:
24.64
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.
4w5u CHITINASE

(Streptomyces
thermoviolaceus) 		no annotation 5 GLY B 306
GLY B 332
ASP B 365
SER B 363
GLU B 398
 None
 1.39A 3tkaA-4w5uB:
undetectable		 3tkaA-4w5uB:
21.36
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.
4xiv CHEMOTAXIS PROTEIN
CHEA

(Thermotoga
maritima) 		PF02518
(HATPase_c)
PF02895
(H-kinase_dim) 		5 GLY A 414
ARG A 452
GLY A 530
ARG A 408
ASP A 412
 ACP  A 601 (-3.4A)
None
None
None
ACP  A 601 (-3.7A)
 1.19A 3tkaA-4xivA:
undetectable		 3tkaA-4xivA:
21.11
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.
4y4n PUTATIVE RIBOSE
1,5-BISPHOSPHATE
ISOMERASE

(Methanotorris
igneus) 		PF01946
(Thi4) 		5 THR A 214
GLY A 225
GLY A 243
ASP A 172
GLU A 216
 None
48H  A 302 (-3.5A)
None
None
None
 1.38A 3tkaA-4y4nA:
2.5		 3tkaA-4y4nA:
25.70
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.
4z3n PUTATIVE DRUG/SODIUM
ANTIPORTER

(Escherichia
coli) 		PF01554
(MatE) 		5 THR A 315
GLY A 318
ARG A  98
GLY A 101
SER A  94
 None
 1.27A 3tkaA-4z3nA:
undetectable		 3tkaA-4z3nA:
23.46
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.
5ch8 MONO- AND
DIACYLGLYCEROL
LIPASE

(Penicillium
cyclopium) 		PF01764
(Lipase_3)
PF03893
(Lipase3_N) 		5 HIS A 144
ASP A  62
PHE A 112
SER A  85
GLU A 109
 None
None
GOL  A 308 (-4.7A)
None
None
 1.29A 3tkaA-5ch8A:
undetectable		 3tkaA-5ch8A:
21.86
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.
5dzu ASPARTIC PROTEASE
INHIBITOR 11

(Solanum
tuberosum) 		PF00197
(Kunitz_legume) 		5 GLY A  34
ARG A  54
GLY A  63
ARG A  29
SER A  26
 None
 1.33A 3tkaA-5dzuA:
undetectable		 3tkaA-5dzuA:
18.34
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.
5e4r KETOL-ACID
REDUCTOISOMERASE

(Ignisphaera
aggregans) 		PF01450
(IlvC)
PF07991
(IlvN) 		5 GLY A 146
ARG A 176
GLY A 178
ARG A 139
GLU A 388
 None
GOL  A 506 (-3.8A)
None
None
None
 1.42A 3tkaA-5e4rA:
4.4		 3tkaA-5e4rA:
21.83
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.
5gkq ALYGC MUTANT - R241A

(Paraglaciecola
chathamensis) 		PF14592
(Chondroitinas_B) 		5 GLY A 236
GLY A 283
HIS A 260
ARG A 175
SER A 234
 None
 1.34A 3tkaA-5gkqA:
undetectable		 3tkaA-5gkqA:
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.
5i1w CRMK

(Actinoalloteichus
sp. WH1-2216-6) 		PF01565
(FAD_binding_4)
PF08031
(BBE) 		5 GLY A 349
ARG A 348
HIS A 351
ARG A 253
SER A 399
 None
 1.28A 3tkaA-5i1wA:
undetectable		 3tkaA-5i1wA:
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.
5j6g H-2 CLASS I
HISTOCOMPATIBILITY
ANTIGEN, Q10 ALPHA
CHAIN

(Mus musculus) 		PF00129
(MHC_I)
PF07654
(C1-set) 		5 ARG A 108
GLY A 104
HIS A   3
ARG A 170
GLU A  55
 None
 1.14A 3tkaA-5j6gA:
undetectable		 3tkaA-5j6gA:
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.
5k6o B-GLUCOSIDASE

(metagenome) 		PF00933
(Glyco_hydro_3)
PF01915
(Glyco_hydro_3_C)
PF14310
(Fn3-like) 		5 THR A  57
GLY A 107
GLY A 103
ASP A 144
PHE A 599
 None
 1.29A 3tkaA-5k6oA:
4.1		 3tkaA-5k6oA:
16.56
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.
5m04 GTPASE OBGE/CGTA

(Escherichia
coli) 		PF01018
(GTP1_OBG)
PF01926
(MMR_HSR1) 		5 THR A  79
GLY A  37
GLY A 124
HIS A 123
ASP A  35
 None
 1.13A 3tkaA-5m04A:
undetectable		 3tkaA-5m04A:
24.19
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.
5mac RIBULOSE-1,5-BISPHOS
PHATE
CARBOXYLASE-OXYGENAS
E TYPE III

(Methanococcoides
burtonii) 		PF00016
(RuBisCO_large)
PF02788
(RuBisCO_large_N) 		5 GLY A 317
GLY A 320
ASP A 141
PHE A 132
GLN A 274
 None
 1.25A 3tkaA-5macA:
undetectable		 3tkaA-5macA:
22.36
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.
5tfv BASIC PHOSPHOLIPASE
A2 MYOTOXIN III

(Bothrops asper) 		PF00068
(Phospholip_A2_1) 		5 GLY A  85
GLY A  87
ARG A  77
SER A  74
GLU A  12
 None
 1.40A 3tkaA-5tfvA:
undetectable		 3tkaA-5tfvA:
14.12
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.
5ume 5,10-METHYLENETETRAH
YDROFOLATE REDUCTASE

(Haemophilus
influenzae) 		PF02219
(MTHFR) 		5 THR A 274
GLY A 208
HIS A 271
ARG A 277
GLN A 217
 None
 0.99A 3tkaA-5umeA:
undetectable		 3tkaA-5umeA:
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.
5y9q CARBON CATABOLITE
RESPONSIVE REGULATOR

(Staphylococcus
aureus) 		PF03466
(LysR_substrate) 		5 THR A  39
GLY A  37
GLY A   6
SER A   9
GLN A 122
 None
 1.29A 3tkaA-5y9qA:
undetectable		 3tkaA-5y9qA:
20.34
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.
5zji PHOTOSYSTEM I
REACTION CENTER
SUBUNIT II

(Zea mays) 		no annotation 5 THR D 106
GLY D  79
GLY D  75
ARG D 123
GLU D 125
 None
 1.21A 3tkaA-5zjiD:
undetectable		 3tkaA-5zjiD:
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.
6czx PHOSPHOSERINE
AMINOTRANSFERASE 1,
CHLOROPLASTIC

(Arabidopsis
thaliana) 		no annotation 5 THR A 197
GLY A 191
GLY A 169
HIS A 223
SER A 193
 None
 1.00A 3tkaA-6czxA:
3.2		 3tkaA-6czxA:
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.
6ehn CARBOHYDRATE
ESTERASE MZ0003

(unidentified
prokaryotic
organism) 		no annotation 5 GLY A 357
ARG A 352
GLY A 355
ASP A 360
GLU A 396
 None
 1.40A 3tkaA-6ehnA:
2.3		 3tkaA-6ehnA:
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.
6f9n PRE-MRNA 3' END
PROCESSING PROTEIN
WDR33

(Homo sapiens) 		no annotation 5 GLY B 351
GLY B 354
HIS B 374
SER B 349
GLU B 207
 None
 1.26A 3tkaA-6f9nB:
undetectable		 3tkaA-6f9nB:
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.
6fmq -

(-) 		no annotation 5 GLY A 462
ARG A 415
GLY A 429
ARG A 507
GLU A 535
 None
ACT  A 706 (-3.3A)
None
None
None
 0.95A 3tkaA-6fmqA:
undetectable		 3tkaA-6fmqA:
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.
6fmq -

(-) 		no annotation 5 GLY A 462
ARG A 415
GLY A 430
ARG A 507
GLU A 535
 None
ACT  A 706 (-3.3A)
None
None
None
 0.86A 3tkaA-6fmqA:
undetectable		 3tkaA-6fmqA:
undetectable