SIMILAR PATTERNS OF AMINO ACIDS FOR 2XKW_B_P1BB1475

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.
1cpc C-PHYCOCYANIN (ALPHA
SUBUNIT)
C-PHYCOCYANIN (BETA
SUBUNIT)

(Microchaete
diplosiphon) 		PF00502
(Phycobilisome) 		5 ILE B  51
PHE B 166
ALA B 101
LEU A  19
ILE B  44
 None
 1.29A 2xkwB-1cpcB:
undetectable		 2xkwB-1cpcB:
23.21
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.
1dbr HYPOXANTHINE GUANINE
XANTHINE
PHOSPHORIBOSYLTRANSF
ERASE

(Toxoplasma
gondii) 		PF00156
(Pribosyltran) 		5 ILE A  77
PHE A 158
SER A 169
LEU A  72
ILE A  75
 None
 1.08A 2xkwB-1dbrA:
undetectable		 2xkwB-1dbrA:
23.41
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.
1dm1 MYOGLOBIN

(Aplysia
limacina) 		PF00042
(Globin) 		5 HIS A  95
SER A  39
ALA A  40
ILE A  67
MET A 111
 HEM  A 148 (-3.3A)
HEM  A 148 (-4.0A)
None
HEM  A 148 (-4.2A)
None
 1.10A 2xkwB-1dm1A:
undetectable		 2xkwB-1dm1A:
22.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1e32 P97

(Mus musculus) 		PF00004
(AAA)
PF02359
(CDC48_N)
PF02933
(CDC48_2) 		5 ILE A 303
PHE A 290
ALA A 339
LEU A 224
ILE A 301
 None
 1.28A 2xkwB-1e32A:
undetectable		 2xkwB-1e32A:
21.98
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.
1e5f METHIONINE
GAMMA-LYASE

(Trichomonas
vaginalis) 		PF01053
(Cys_Met_Meta_PP) 		5 ILE A 132
GLU A 108
HIS A 115
ALA A  91
LEU A  98
 None
 1.34A 2xkwB-1e5fA:
0.0		 2xkwB-1e5fA:
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.
1f99 R-PHYCOCYANIN

(Polysiphonia
urceolata) 		PF00502
(Phycobilisome) 		5 ILE B  51
PHE B 164
ALA B  99
LEU A  19
ILE B  44
 None
 1.31A 2xkwB-1f99B:
undetectable		 2xkwB-1f99B:
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.
1g71 DNA PRIMASE

(Pyrococcus
furiosus) 		PF01896
(DNA_primase_S) 		5 ILE A 174
SER A 146
ALA A 305
LEU A 291
ILE A 152
 None
 1.17A 2xkwB-1g71A:
1.1		 2xkwB-1g71A:
21.80
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.
1ir6 EXONUCLEASE RECJ

(Thermus
thermophilus) 		PF01368
(DHH)
PF02272
(DHHA1) 		5 GLU A 209
HIS A 199
ALA A  61
LEU A 133
ILE A  91
 None
 1.34A 2xkwB-1ir6A:
0.0		 2xkwB-1ir6A:
21.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1mqs SLY1 PROTEIN

(Saccharomyces
cerevisiae) 		PF00995
(Sec1) 		5 ILE A 216
GLU A 229
ALA A 178
LEU A 173
ILE A 263
 None
 1.16A 2xkwB-1mqsA:
0.0		 2xkwB-1mqsA:
19.63
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.
1ocm MALONAMIDASE E2

(Bradyrhizobium
japonicum) 		PF01425
(Amidase) 		5 PHE A  39
HIS A  42
ALA A  48
LEU A   7
ILE A 144
 None
 1.27A 2xkwB-1ocmA:
undetectable		 2xkwB-1ocmA:
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.
1qgd PROTEIN
(TRANSKETOLASE)

(Escherichia
coli) 		PF00456
(Transketolase_N)
PF02779
(Transket_pyr)
PF02780
(Transketolase_C) 		5 ILE A 345
CYH A 494
ALA A 556
LEU A 543
ILE A 536
 None
 1.24A 2xkwB-1qgdA:
0.0		 2xkwB-1qgdA:
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.
1v5b 3-ISOPROPYLMALATE
DEHYDROGENASE

(Bacillus
coagulans) 		PF00180
(Iso_dh) 		5 ILE A 167
GLU A 241
SER A 266
ALA A 265
ILE A 170
 None
 1.20A 2xkwB-1v5bA:
undetectable		 2xkwB-1v5bA:
22.91
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.
1yvd RAS-RELATED PROTEIN
RAB-22A

(Mus musculus) 		PF00071
(Ras) 		5 ILE A  87
GLU A 130
PHE A 144
ALA A  80
LEU A  10
 None
 1.00A 2xkwB-1yvdA:
undetectable		 2xkwB-1yvdA:
21.55
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.
2bv8 C-PHYCOCYANIN ALPHA
SUBUNIT
C-PHYCOCYANIN BETA
SUBUNIT

(Gracilaria
chilensis) 		PF00502
(Phycobilisome) 		5 ILE B  51
PHE B 164
ALA B  99
LEU A  19
ILE B  44
 None
 1.32A 2xkwB-2bv8B:
undetectable		 2xkwB-2bv8B:
20.29
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.
2cda GLUCOSE
DEHYDROGENASE

(Sulfolobus
solfataricus) 		PF08240
(ADH_N)
PF16912
(Glu_dehyd_C) 		5 ILE A 162
SER A 280
ALA A 256
LEU A 261
ILE A 251
 None
None
NAP  A1367 (-3.3A)
None
None
 1.26A 2xkwB-2cdaA:
undetectable		 2xkwB-2cdaA:
22.63
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.
2csu 457AA LONG
HYPOTHETICAL PROTEIN

(Pyrococcus
horikoshii) 		PF13380
(CoA_binding_2)
PF13607
(Succ_CoA_lig) 		5 ILE A 125
PHE A   6
ALA A 205
LEU A 208
ILE A 180
 None
 1.09A 2xkwB-2csuA:
undetectable		 2xkwB-2csuA:
21.98
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.
2dq7 PROTO-ONCOGENE
TYROSINE-PROTEIN
KINASE FYN

(Homo sapiens) 		PF07714
(Pkinase_Tyr) 		5 ILE X 121
PHE X 149
LEU X  90
ILE X 146
MET X 118
 None
 1.26A 2xkwB-2dq7X:
undetectable		 2xkwB-2dq7X:
22.87
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.
2dq7 PROTO-ONCOGENE
TYROSINE-PROTEIN
KINASE FYN

(Homo sapiens) 		PF07714
(Pkinase_Tyr) 		5 ILE X 121
PHE X 149
SER X  89
ILE X 146
MET X 118
 None
None
STU  X 902 ( 4.0A)
None
None
 1.13A 2xkwB-2dq7X:
undetectable		 2xkwB-2dq7X:
22.87
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.
2drq XYLANASE Y

(Bacillus
halodurans) 		PF01270
(Glyco_hydro_8) 		5 ILE A 291
SER A 226
ALA A 223
LEU A 200
ILE A 271
 None
 1.27A 2xkwB-2drqA:
undetectable		 2xkwB-2drqA:
18.84
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.
2hqy CONSERVED
HYPOTHETICAL PROTEIN

(Bacteroides
thetaiotaomicron) 		PF09924
(DUF2156) 		5 PHE A  54
SER A  36
LEU A 204
ILE A  15
MET A 224
 None
 1.32A 2xkwB-2hqyA:
undetectable		 2xkwB-2hqyA:
20.55
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.
2okx RHAMNOSIDASE B

(Bacillus sp.
GL1) 		PF05592
(Bac_rhamnosid)
PF08531
(Bac_rhamnosid_N)
PF17389
(Bac_rhamnosid6H)
PF17390
(Bac_rhamnosid_C) 		5 ILE A  78
PHE A  30
ALA A 176
LEU A 111
ILE A  90
 None
 1.03A 2xkwB-2okxA:
undetectable		 2xkwB-2okxA:
13.63
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.
2ox4 PUTATIVE MANDELATE
RACEMASE

(Zymomonas
mobilis) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		5 ILE A 211
GLU A 213
HIS A 315
SER A 326
ALA A 329
 None
MG  A 402 (-3.3A)
None
None
None
 1.19A 2xkwB-2ox4A:
undetectable		 2xkwB-2ox4A:
21.32
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.
2ox4 PUTATIVE MANDELATE
RACEMASE

(Zymomonas
mobilis) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		5 ILE A 211
GLU A 213
SER A 326
ALA A 329
LEU A 124
 None
MG  A 402 (-3.3A)
None
None
None
 1.26A 2xkwB-2ox4A:
undetectable		 2xkwB-2ox4A:
21.32
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2p54 PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR ALPHA

(Homo sapiens) 		PF00104
(Hormone_recep) 		5 ILE A 241
GLU A 251
SER A 280
LEU A 321
MET A 355
 735  A 469 (-4.7A)
None
735  A 469 (-2.8A)
735  A 469 ( 4.3A)
735  A 469 (-2.9A)
 0.59A 2xkwB-2p54A:
34.0		 2xkwB-2p54A:
61.94
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.
2pbl PUTATIVE
ESTERASE/LIPASE/THIO
ESTERASE

(Ruegeria sp.
TM1040) 		PF07859
(Abhydrolase_3) 		5 ILE A 165
PHE A  67
SER A  26
ALA A  25
ILE A 245
 None
 1.32A 2xkwB-2pblA:
undetectable		 2xkwB-2pblA:
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.
2qvw GLP_546_48378_50642

(Giardia
intestinalis) 		PF00636
(Ribonuclease_3)
PF02170
(PAZ) 		5 ILE A 272
PHE A  48
SER A  17
LEU A 262
ILE A 268
 None
 1.29A 2xkwB-2qvwA:
undetectable		 2xkwB-2qvwA:
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.
2r0h CGL3 LECTIN

(Coprinopsis
cinerea) 		PF00337
(Gal-bind_lectin) 		5 ILE A 114
PHE A 145
SER A 134
LEU A  50
ILE A 101
 None
 1.26A 2xkwB-2r0hA:
undetectable		 2xkwB-2r0hA:
20.22
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.
2r5v PCZA361.1

(Amycolatopsis
orientalis) 		PF00903
(Glyoxalase)
PF14696
(Glyoxalase_5) 		5 ILE A 192
HIS A 241
LEU A 231
ILE A 216
MET A 199
 None
CO  A4113 ( 3.4A)
None
None
None
 1.05A 2xkwB-2r5vA:
undetectable		 2xkwB-2r5vA:
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.
2rc5 FERREDOXIN-NADP
REDUCTASE

(Leptospira
interrogans) 		PF00175
(NAD_binding_1) 		5 ILE A 283
GLU A 304
SER A  97
ALA A 178
ILE A 271
 None
None
FAD  A 415 (-3.1A)
FAD  A 415 ( 3.9A)
None
 1.20A 2xkwB-2rc5A:
undetectable		 2xkwB-2rc5A:
20.31
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.
2wbi ACYL-COA
DEHYDROGENASE FAMILY
MEMBER 11

(Homo sapiens) 		PF00441
(Acyl-CoA_dh_1)
PF02770
(Acyl-CoA_dh_M)
PF02771
(Acyl-CoA_dh_N) 		5 ILE A 271
SER A 187
ALA A 190
ILE A 199
MET A 217
 None
 1.22A 2xkwB-2wbiA:
undetectable		 2xkwB-2wbiA:
19.39
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.
2zv7 TYROSINE-PROTEIN
KINASE LYN

(Mus musculus) 		PF07714
(Pkinase_Tyr) 		5 ILE A 358
PHE A 386
LEU A 327
ILE A 383
MET A 355
 None
 1.34A 2xkwB-2zv7A:
undetectable		 2xkwB-2zv7A:
21.52
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3b0q PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA

(Homo sapiens) 		PF00104
(Hormone_recep) 		7 ILE A 249
ARG A 288
SER A 289
ALA A 292
LEU A 330
MET A 348
MET A 364
 None
None
MC5  A   1 (-2.6A)
None
MC5  A   1 (-4.4A)
MC5  A   1 ( 4.0A)
MC5  A   1 (-3.7A)
 0.54A 2xkwB-3b0qA:
37.2		 2xkwB-3b0qA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3b0q PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA

(Homo sapiens) 		PF00104
(Hormone_recep) 		8 ILE A 249
GLU A 259
ARG A 288
ALA A 292
LEU A 330
ILE A 341
MET A 348
MET A 364
 None
None
None
None
MC5  A   1 (-4.4A)
MC5  A   1 (-4.5A)
MC5  A   1 ( 4.0A)
MC5  A   1 (-3.7A)
 0.57A 2xkwB-3b0qA:
37.2		 2xkwB-3b0qA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3b0q PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA

(Homo sapiens) 		PF00104
(Hormone_recep) 		8 ILE A 249
GLU A 259
CYH A 285
ARG A 288
ALA A 292
LEU A 330
ILE A 341
MET A 364
 None
None
MC5  A   1 (-3.6A)
None
None
MC5  A   1 (-4.4A)
MC5  A   1 (-4.5A)
MC5  A   1 (-3.7A)
 0.78A 2xkwB-3b0qA:
37.2		 2xkwB-3b0qA:
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.
3bac DNA LIGASE

(Haemophilus
influenzae) 		PF01653
(DNA_ligase_aden) 		5 ILE A  98
GLU A 300
ALA A 242
LEU A 260
ILE A 292
 None
 1.32A 2xkwB-3bacA:
undetectable		 2xkwB-3bacA:
22.59
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3d5f PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR DELTA

(Homo sapiens) 		PF00104
(Hormone_recep) 		5 ILE A 456
ALA A 371
LEU A 445
ILE A 363
MET A 453
 None
None
None
L41  A 501 ( 4.4A)
L41  A 501 ( 3.7A)
 1.20A 2xkwB-3d5fA:
33.4		 2xkwB-3d5fA:
61.31
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.
3d5p PUTATIVE GLUCAN
SYNTHESIS REGULATOR
OF SMI1/KNR4 FAMILY

(Bacteroides
fragilis) 		PF09346
(SMI1_KNR4) 		5 ILE A  58
GLU A  23
SER A 117
ALA A 115
LEU A 122
 None
 1.11A 2xkwB-3d5pA:
undetectable		 2xkwB-3d5pA:
19.38
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3dzu PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA

(Homo sapiens) 		PF00104
(Hormone_recep)
PF00105
(zf-C4) 		8 ILE D 249
CYH D 285
SER D 289
ALA D 292
LEU D 330
ILE D 341
MET D 348
MET D 364
 None
PLB  D 701 (-3.2A)
PLB  D 701 ( 3.9A)
PLB  D 701 ( 4.1A)
PLB  D 701 ( 4.1A)
PLB  D 701 (-3.6A)
PLB  D 701 ( 4.7A)
PLB  D 701 ( 4.8A)
 0.40A 2xkwB-3dzuD:
34.5		 2xkwB-3dzuD:
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.
3f3s LAMBDA-CRYSTALLIN
HOMOLOG

(Homo sapiens) 		PF00725
(3HCDH)
PF02737
(3HCDH_N) 		5 ILE A  81
CYH A  94
SER A 122
ALA A 144
ILE A  91
 None
None
NAD  A 601 (-4.6A)
None
None
 1.31A 2xkwB-3f3sA:
undetectable		 2xkwB-3f3sA:
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.
3fdh SUSD HOMOLOG

(Bacteroides
thetaiotaomicron) 		PF12771
(SusD-like_2) 		5 ILE A  62
PHE A 148
CYH A 141
ALA A 157
ILE A 103
 None
 1.09A 2xkwB-3fdhA:
undetectable		 2xkwB-3fdhA:
19.83
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.
3gha DISULFIDE BOND
FORMATION PROTEIN D

(Bacillus
subtilis) 		PF13462
(Thioredoxin_4) 		5 GLU A  63
PHE A  97
HIS A 129
ALA A 153
LEU A 148
 EDO  A 301 (-3.6A)
EDO  A 301 (-4.6A)
EDO  A 301 (-3.8A)
None
None
 1.18A 2xkwB-3ghaA:
undetectable		 2xkwB-3ghaA:
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.
3gvc PROBABLE SHORT-CHAIN
TYPE
DEHYDROGENASE/REDUCT
ASE

(Mycobacterium
tuberculosis) 		PF13561
(adh_short_C2) 		5 GLU A 192
ARG A 199
ALA A 258
LEU A 254
ILE A 198
 None
 1.32A 2xkwB-3gvcA:
undetectable		 2xkwB-3gvcA:
17.99
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.
3hmj FATTY ACID SYNTHASE
SUBUNIT ALPHA

(Saccharomyces
cerevisiae) 		PF00109
(ketoacyl-synt)
PF01648
(ACPS)
PF02801
(Ketoacyl-synt_C) 		5 ILE A1326
PHE A1223
ALA A1033
ILE A1386
MET A1388
 None
 1.15A 2xkwB-3hmjA:
undetectable		 2xkwB-3hmjA:
9.27
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.
3hmj FATTY ACID SYNTHASE
SUBUNIT ALPHA

(Saccharomyces
cerevisiae) 		PF00109
(ketoacyl-synt)
PF01648
(ACPS)
PF02801
(Ketoacyl-synt_C) 		5 ILE A1326
PHE A1223
ALA A1033
LEU A1597
ILE A1386
 None
 1.06A 2xkwB-3hmjA:
undetectable		 2xkwB-3hmjA:
9.27
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.
3ibs CONSERVED
HYPOTHETICAL PROTEIN
BATB

(Bacteroides
thetaiotaomicron) 		PF00092
(VWA) 		5 ILE A 112
SER A 204
ALA A 207
LEU A  42
ILE A 110
 None
 1.00A 2xkwB-3ibsA:
undetectable		 2xkwB-3ibsA:
21.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3io5 RECOMBINATION AND
REPAIR PROTEIN

(Escherichia
virus T4) 		PF00154
(RecA) 		5 ILE A  41
GLU A  46
ALA A 218
LEU A  58
MET A  73
 None
 1.32A 2xkwB-3io5A:
undetectable		 2xkwB-3io5A:
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.
3kd8 2,3-BISPHOSPHOGLYCER
ATE-INDEPENDENT
PHOSPHOGLYCERATE
MUTASE

(Thermoplasma
acidophilum) 		PF01676
(Metalloenzyme)
PF10143
(PhosphMutase) 		5 ILE A 382
PHE A 357
LEU A  12
ILE A 355
MET A  46
 None
 1.24A 2xkwB-3kd8A:
undetectable		 2xkwB-3kd8A:
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.
3nea PEPTIDYL-TRNA
HYDROLASE

(Francisella
tularensis) 		PF01195
(Pept_tRNA_hydro) 		5 ILE A  85
SER A 120
LEU A  10
ILE A  90
MET A   6
 None
 1.26A 2xkwB-3neaA:
undetectable		 2xkwB-3neaA:
21.91
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.
3pf2 CELL WALL SURFACE
ANCHOR FAMILY
PROTEIN

(Streptococcus
agalactiae) 		PF16569
(GramPos_pilinBB)
PF16570
(GramPos_pilinD3) 		5 ILE A 437
SER A 493
ALA A 508
LEU A 345
ILE A 449
 None
 1.10A 2xkwB-3pf2A:
undetectable		 2xkwB-3pf2A:
23.53
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.
3pk1 INDUCED MYELOID
LEUKEMIA CELL
DIFFERENTIATION
PROTEIN MCL-1

(Homo sapiens) 		PF00452
(Bcl-2) 		5 PHE A 254
SER A 269
ALA A 272
LEU A 213
ILE A 264
 None
 1.33A 2xkwB-3pk1A:
undetectable		 2xkwB-3pk1A:
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.
3pn1 DNA LIGASE

(Haemophilus
influenzae) 		PF01653
(DNA_ligase_aden) 		5 ILE A  98
GLU A 300
ALA A 242
LEU A 260
ILE A 292
 None
 1.25A 2xkwB-3pn1A:
undetectable		 2xkwB-3pn1A:
23.72
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.
3ram HMRA PROTEIN

(Staphylococcus
aureus) 		PF01546
(Peptidase_M20)
PF07687
(M20_dimer) 		5 ILE A 382
GLU A 371
SER A 102
LEU A  80
ILE A 151
 None
 1.20A 2xkwB-3ramA:
undetectable		 2xkwB-3ramA:
20.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3tlf ENOYL-COA
HYDRATASE/ISOMERASE

(Mycobacterium
avium) 		PF00378
(ECH_1) 		5 GLU A  12
ARG A  24
ALA A  27
LEU A  31
ILE A   9
 None
 1.23A 2xkwB-3tlfA:
undetectable		 2xkwB-3tlfA:
21.71
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.
3ty4 PROBABLE
HOMOISOCITRATE
DEHYDROGENASE

(Schizosaccharomyces
pombe) 		PF00180
(Iso_dh) 		5 GLU A  70
SER A 284
ALA A 275
LEU A 313
MET A  29
 None
 1.21A 2xkwB-3ty4A:
undetectable		 2xkwB-3ty4A:
21.12
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.
3vti HYDROGENASE
MATURATION FACTOR

(Caldanaerobacter
subterraneus) 		PF00586
(AIRS)
PF02769
(AIRS_C) 		5 ILE C 175
GLU C 248
SER C 187
ALA C 315
LEU C 224
 None
 1.14A 2xkwB-3vtiC:
undetectable		 2xkwB-3vtiC:
25.07
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.
3ziu LEUCYL-TRNA
SYNTHETASE

(Mycoplasma
mobile) 		PF00133
(tRNA-synt_1)
PF08264
(Anticodon_1) 		5 ILE A 498
ALA A  40
ILE A 502
MET A 510
MET A 438
 None
 1.34A 2xkwB-3ziuA:
undetectable		 2xkwB-3ziuA:
18.91
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.
4a2q RETINOIC ACID
INDUCIBLE PROTEIN I

(Anas
platyrhynchos) 		PF00270
(DEAD)
PF00271
(Helicase_C)
PF16739
(CARD_2) 		5 ILE A 137
GLU A 133
LEU A 173
ILE A 125
MET A 113
 None
 1.05A 2xkwB-4a2qA:
undetectable		 2xkwB-4a2qA:
17.85
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.
4a2w RETINOIC ACID
INDUCIBLE PROTEIN I

(Anas
platyrhynchos) 		PF00270
(DEAD)
PF00271
(Helicase_C)
PF16739
(CARD_2) 		5 ILE A 137
GLU A 133
LEU A 173
ILE A 125
MET A 113
 None
 1.25A 2xkwB-4a2wA:
undetectable		 2xkwB-4a2wA:
15.59
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.
4azw WBDD

(Escherichia
coli) 		PF00069
(Pkinase)
PF13847
(Methyltransf_31) 		5 ILE A 191
GLU A  42
SER A  68
ILE A 158
MET A 205
 None
 1.26A 2xkwB-4azwA:
undetectable		 2xkwB-4azwA:
23.20
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.
4cgs POLYMERASE SUBUNIT
PA

(Dhori
thogotovirus) 		no annotation 6 ILE A   9
PHE A 147
HIS A  45
CYH A  43
ILE A  38
MET A  62
 None
None
CME  A  44 ( 4.9A)
CME  A  44 ( 4.8A)
None
None
 1.37A 2xkwB-4cgsA:
undetectable		 2xkwB-4cgsA:
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.
4e09 PLASMID PARTITIONING
PROTEIN PARF

(Escherichia
coli) 		PF01656
(CbiA) 		6 ILE A 201
PHE A   6
ALA A  60
LEU A  73
ILE A  80
MET A   1
 None
 1.31A 2xkwB-4e09A:
undetectable		 2xkwB-4e09A:
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.
4e3z PUTATIVE
OXIDOREDUCTASE
PROTEIN

(Rhizobium etli) 		PF13561
(adh_short_C2) 		5 GLU A 176
ARG A 183
ALA A 236
LEU A 232
ILE A 182
 None
 1.31A 2xkwB-4e3zA:
undetectable		 2xkwB-4e3zA:
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.
4g4s PROTEASOME CHAPERONE
1

(Saccharomyces
cerevisiae) 		PF10450
(POC1) 		5 ILE O 166
PHE O  61
ALA O 266
ILE O 168
MET O 177
 None
 1.23A 2xkwB-4g4sO:
undetectable		 2xkwB-4g4sO:
22.85
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.
4gi5 QUINONE REDUCTASE

(Klebsiella
pneumoniae) 		PF02525
(Flavodoxin_2) 		5 ILE A 176
PHE A  98
SER A  37
LEU A  88
MET A 180
 None
 1.27A 2xkwB-4gi5A:
undetectable		 2xkwB-4gi5A:
19.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4h5u PROBABLE HYDROLASE
NIT2

(Saccharomyces
cerevisiae) 		PF00795
(CN_hydrolase) 		5 ILE A 115
GLU A 124
ALA A 194
LEU A  13
ILE A  90
 None
None
CAF  A 169 ( 4.4A)
None
None
 1.30A 2xkwB-4h5uA:
undetectable		 2xkwB-4h5uA:
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.
4ijr D-ARABINOSE
DEHYDROGENASE
[NAD(P)+] HEAVY
CHAIN

(Saccharomyces
cerevisiae) 		PF00248
(Aldo_ket_red) 		5 ILE A 281
ARG A 285
SER A 286
LEU A 243
ILE A 283
 None
NDP  A 401 (-2.8A)
NDP  A 401 (-2.7A)
NDP  A 401 (-3.8A)
NDP  A 401 (-4.4A)
 1.22A 2xkwB-4ijrA:
undetectable		 2xkwB-4ijrA:
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.
4jer HEMOPHORE HASA

(Yersinia pestis) 		PF06438
(HasA) 		5 GLU A  22
ALA A  69
LEU A 119
ILE A 114
MET A 158
 None
 1.34A 2xkwB-4jerA:
undetectable		 2xkwB-4jerA:
20.28
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.
4oro POLYMERASE PB2

(Influenza B
virus) 		PF00604
(Flu_PB2) 		5 GLU A 467
PHE A 448
SER A 407
LEU A 376
ILE A 400
 None
 1.15A 2xkwB-4oroA:
undetectable		 2xkwB-4oroA:
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.
4qsl PYRUVATE CARBOXYLASE

(Listeria
monocytogenes) 		no annotation 5 ILE H  17
GLU H  14
HIS H 299
SER H 313
LEU H  26
 None
 1.34A 2xkwB-4qslH:
undetectable		 2xkwB-4qslH:
12.28
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.
4rap GLYCOSYLTRANSFERASE
TIBC

(Escherichia
coli) 		PF01075
(Glyco_transf_9) 		5 GLU A 326
PHE A 187
HIS A 188
ALA A 118
LEU A 141
 None
 1.21A 2xkwB-4rapA:
undetectable		 2xkwB-4rapA:
24.94
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.
4s1t URIDYLATE-SPECIFIC
ENDORIBONUCLEASE

(Human
coronavirus
229E) 		PF06471
(NSP11) 		5 ILE A 150
SER A 273
ALA A 272
LEU A  94
ILE A  71
 None
 1.18A 2xkwB-4s1tA:
undetectable		 2xkwB-4s1tA:
23.06
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.
4twg MOLYBDOPTERIN
BIOSYNTHESIS MOG
PROTEIN

(Mycobacterium
ulcerans) 		PF00994
(MoCF_biosynth) 		5 ILE A  10
CYH A 118
ALA A 150
LEU A 143
ILE A  67
 None
 1.33A 2xkwB-4twgA:
undetectable		 2xkwB-4twgA:
22.63
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.
4yhc STEROL REGULATORY
ELEMENT-BINDING
PROTEIN
CLEAVAGE-ACTIVATING
PROTEIN

(Schizosaccharomyces
pombe) 		no annotation 5 PHE A 689
SER A 767
ALA A 751
LEU A 814
ILE A 744
 None
CIT  A1102 ( 4.6A)
CIT  A1102 ( 4.2A)
None
None
 1.20A 2xkwB-4yhcA:
undetectable		 2xkwB-4yhcA:
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.
4ypv EST8

(Parvibaculum) 		PF07859
(Abhydrolase_3) 		5 ILE A  22
HIS A  97
ALA A 290
LEU A  10
ILE A  37
 None
 1.26A 2xkwB-4ypvA:
undetectable		 2xkwB-4ypvA:
20.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4z6k ALCOHOL
DEHYDROGENASE

(Moraxella sp.
TAE123) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		5 ILE A 328
ALA A   3
LEU A  13
ILE A 319
MET A 323
 None
 1.33A 2xkwB-4z6kA:
undetectable		 2xkwB-4z6kA:
21.82
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.
5bp3 MYCOCEROSIC ACID
SYNTHASE-LIKE
POLYKETIDE SYNTHASE

(Mycolicibacterium
smegmatis) 		PF14765
(PS-DH) 		5 PHE A1059
HIS A1055
SER A1105
ALA A1077
LEU A1156
 None
 1.26A 2xkwB-5bp3A:
undetectable		 2xkwB-5bp3A:
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.
5ce0 NATIVE CONSERPIN
WITH Z-VARIANT
(E342K)

(synthetic
construct) 		PF00079
(Serpin) 		5 PHE A  30
HIS A 305
SER A  37
ALA A  40
LEU A  73
 None
 1.28A 2xkwB-5ce0A:
undetectable		 2xkwB-5ce0A:
24.16
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.
5d1p ATP-DEPENDENT RNA
LIGASE

(Methanothermobacter
thermautotrophicus) 		PF09414
(RNA_ligase) 		5 ILE A  13
PHE A  46
LEU A 108
ILE A  59
MET A  41
 None
 1.30A 2xkwB-5d1pA:
undetectable		 2xkwB-5d1pA:
23.31
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.
5dt5 BETA-GLUCOSIDASE

(Exiguobacterium
antarcticum) 		PF00232
(Glyco_hydro_1) 		5 ILE A 390
PHE A 330
ALA A 243
LEU A 248
ILE A 291
 None
 1.32A 2xkwB-5dt5A:
undetectable		 2xkwB-5dt5A:
20.75
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.
5e37 EF-HAND
DOMAIN-CONTAINING
THIOREDOXIN

(Chlamydomonas
reinhardtii) 		PF00085
(Thioredoxin)
PF13499
(EF-hand_7) 		5 GLU A 216
ALA A 116
LEU A 178
ILE A 164
MET A 153
 GLU  A 216 ( 0.5A)
ALA  A 116 ( 0.0A)
LEU  A 178 ( 0.6A)
ILE  A 164 ( 0.7A)
MET  A 153 ( 0.0A)
 1.31A 2xkwB-5e37A:
undetectable		 2xkwB-5e37A:
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.
5fbh EXTRACELLULAR
CALCIUM-SENSING
RECEPTOR

(Homo sapiens) 		no annotation 5 ILE B 528
GLU B 525
PHE B 204
ALA B 194
ILE B 318
 None
 1.25A 2xkwB-5fbhB:
undetectable		 2xkwB-5fbhB:
19.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5fds PROFILIN-2

(Hevea
brasiliensis) 		PF00235
(Profilin) 		5 ILE A  50
GLU A  46
PHE A  42
SER A  21
ILE A 103
 None
 1.20A 2xkwB-5fdsA:
undetectable		 2xkwB-5fdsA:
20.44
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5gmt ALGINATE LYASE

(Aplysia kurodai) 		no annotation 5 ILE A 200
PHE A 174
ALA A  46
ILE A 182
MET A 230
 None
 1.08A 2xkwB-5gmtA:
undetectable		 2xkwB-5gmtA:
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.
5iy7 TRANSCRIPTION
INITIATION FACTOR
IIE SUBUNIT BETA

(Homo sapiens) 		PF02186
(TFIIE_beta) 		5 GLU R 131
PHE R 139
ARG R 146
ALA R 174
LEU R 151
 None
 1.32A 2xkwB-5iy7R:
undetectable		 2xkwB-5iy7R:
22.91
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.
5l7z MATERNAL PROTEIN
EXUPERANTIA

(Drosophila
melanogaster) 		no annotation 5 ILE A  40
SER A 164
ALA A 163
LEU A 116
ILE A 148
 None
 1.33A 2xkwB-5l7zA:
undetectable		 2xkwB-5l7zA:
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.
5la0 CARBOHYDRATE BINDING
FAMILY 6

(Ruminiclostridium
thermocellum) 		PF00150
(Cellulase)
PF03422
(CBM_6) 		6 ILE A 115
GLU A  94
PHE A 150
ALA A 251
LEU A 308
ILE A 131
 None
 1.50A 2xkwB-5la0A:
undetectable		 2xkwB-5la0A:
20.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5lc5 NADH-UBIQUINONE
OXIDOREDUCTASE CHAIN
4

(Bos taurus) 		PF00361
(Proton_antipo_M)
PF01059
(Oxidored_q5_N) 		5 ILE M 225
ALA M 124
LEU M 236
ILE M 132
MET M 229
 None
 1.32A 2xkwB-5lc5M:
undetectable		 2xkwB-5lc5M:
22.34
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.
5me3 SISTER CHROMATID
COHESION PROTEIN 2

(Eremothecium
gossypii) 		PF12765
(Cohesin_HEAT)
PF12830
(Nipped-B_C) 		5 ILE A 744
CYH A 708
ARG A 707
LEU A 553
ILE A 706
 None
 1.18A 2xkwB-5me3A:
undetectable		 2xkwB-5me3A:
13.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5n81 TYROCIDINE SYNTHASE
1

(Brevibacillus
parabrevis) 		no annotation 5 GLU A  99
SER A 248
ALA A 247
LEU A 272
ILE A 251
 None
 1.29A 2xkwB-5n81A:
undetectable		 2xkwB-5n81A:
16.31
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.
5nd4 TUBULIN ALPHA CHAIN

(Bos taurus) 		PF00091
(Tubulin)
PF03953
(Tubulin_C) 		5 ILE A 209
SER A 237
ALA A 240
LEU A  23
ILE A 231
 None
 1.21A 2xkwB-5nd4A:
undetectable		 2xkwB-5nd4A:
20.62
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.
5nue MALATE DEHYDROGENASE
1, CYTOPLASMIC

(Arabidopsis
thaliana) 		no annotation 5 ILE A 285
ALA A 122
LEU A 117
ILE A 153
MET A  87
 None
 1.31A 2xkwB-5nueA:
undetectable		 2xkwB-5nueA:
15.62
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.
5t4z ANTIBODY DH501 FAB
HEAVY CHAIN
ANTIBODY DH501 FAB
LIGHT CHAIN

(Macaca mulatta) 		no annotation 5 ILE H 100
PHE L  98
ARG H  38
LEU H  80
ILE H  37
 None
 1.28A 2xkwB-5t4zH:
undetectable		 2xkwB-5t4zH:
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.
5ubv ATPASE DOMAIN OF
I-AAA PROTEASE

(Thermothelomyces
thermophila) 		no annotation 5 GLU A 132
PHE A  91
ALA A  60
LEU A  21
ILE A 144
 None
 1.11A 2xkwB-5ubvA:
undetectable		 2xkwB-5ubvA:
13.65
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.
5vf6 SINGLE CHAIN
VARIABLE FRAGMENT

(Gallus gallus) 		no annotation 5 ILE A 232
PHE A  96
ARG A 161
LEU A 204
ILE A 160
 None
 1.28A 2xkwB-5vf6A:
undetectable		 2xkwB-5vf6A:
15.83
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.
6aqy GDP-L-FUCOSE
SYNTHETASE

(Naegleria
fowleri) 		PF01370
(Epimerase) 		5 ILE A 271
PHE A 313
ALA A 235
LEU A  27
MET A 204
 None
 1.31A 2xkwB-6aqyA:
undetectable		 2xkwB-6aqyA:
19.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6b9u DNA GYRASE, SUBUNIT
B:SHORT-CHAIN
DEHYDROGENASE/REDUCT
ASE
SDR:GLUCOSE/RIBITOL
DEHYDROGENASE

(Brucella
abortus) 		no annotation 5 ILE A 124
GLU A 174
ARG A 181
ALA A 237
ILE A 180
 None
 1.32A 2xkwB-6b9uA:
undetectable		 2xkwB-6b9uA:
20.62
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.
6g7x -

(-) 		no annotation 5 ILE A  28
PHE A 221
ALA A 106
ILE A  88
MET A 231
 None
 1.33A 2xkwB-6g7xA:
undetectable		 2xkwB-6g7xA:
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.
6g7x -

(-) 		no annotation 5 ILE A  28
PHE A 221
LEU A 197
ILE A  88
MET A 231
 None
 1.21A 2xkwB-6g7xA:
undetectable		 2xkwB-6g7xA:
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.
6gii CYTOCHROME P450

(Tepidiphilus
thermophilus) 		no annotation 5 ILE A 334
ALA A 189
LEU A 201
ILE A 433
MET A 443
 None
 1.29A 2xkwB-6giiA:
undetectable		 2xkwB-6giiA:
16.29
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.
6gui -

(-) 		no annotation 5 ILE A  51
CYH A 167
ARG A 141
ILE A  49
MET A 204
 None
 1.29A 2xkwB-6guiA:
undetectable		 2xkwB-6guiA:
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.
1a6c TOBACCO RINGSPOT
VIRUS CAPSID PROTEIN

(Tobacco
ringspot virus) 		PF03391
(Nepo_coat)
PF03688
(Nepo_coat_C)
PF03689
(Nepo_coat_N) 		4 LEU A 128
ARG A  34
ILE A  37
ILE A 159
 None
 0.93A 2xkwB-1a6cA:
undetectable		 2xkwB-1a6cA:
17.73
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.
1b25 PROTEIN
(FORMALDEHYDE
FERREDOXIN
OXIDOREDUCTASE)

(Pyrococcus
furiosus) 		PF01314
(AFOR_C)
PF02730
(AFOR_N) 		4 LEU A 509
ILE A  32
ILE A  59
LEU A  76
 None
 0.75A 2xkwB-1b25A:
0.0		 2xkwB-1b25A:
20.55
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.
1bk6 KARYOPHERIN ALPHA

(Saccharomyces
cerevisiae) 		PF00514
(Arm)
PF16186
(Arm_3) 		4 LEU A 350
ILE A 365
ILE A 292
LEU A 304
 None
 0.82A 2xkwB-1bk6A:
0.0		 2xkwB-1bk6A:
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.
1cbk PROTEIN
(7,8-DIHYDRO-6-HYDRO
XYMETHYLPTERIN-PYROP
HOSPHOKINASE)

(Haemophilus
influenzae) 		PF01288
(HPPK) 		4 LEU A  71
ILE A  98
ILE A 131
LEU A  34
 None
 0.96A 2xkwB-1cbkA:
undetectable		 2xkwB-1cbkA:
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.
1csj HEPATITIS C VIRUS
RNA POLYMERASE
(NS5B)

(Hepacivirus C) 		PF00998
(RdRP_3) 		4 LEU A 489
ILE A 424
ILE A 463
LEU A 474
 None
 0.95A 2xkwB-1csjA:
0.0		 2xkwB-1csjA:
19.63
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.
1ezw COENZYME
F420-DEPENDENT
N5,N10-METHYLENETETR
AHYDROMETHANOPTERIN
REDUCTASE

(Methanopyrus
kandleri) 		PF00296
(Bac_luciferase) 		4 LEU A  10
ILE A 328
ILE A 295
MET A 294
 None
 0.97A 2xkwB-1ezwA:
0.0		 2xkwB-1ezwA:
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.
1h81 POLYAMINE OXIDASE

(Zea mays) 		PF01593
(Amino_oxidase) 		4 LEU A 233
ILE A  40
ILE A 448
LEU A  23
 None
 0.88A 2xkwB-1h81A:
0.0		 2xkwB-1h81A:
20.62
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.
1id1 PUTATIVE POTASSIUM
CHANNEL PROTEIN

(Escherichia
coli) 		PF02254
(TrkA_N) 		4 ARG A  73
ILE A  71
ILE A 123
LEU A  80
 None
 0.91A 2xkwB-1id1A:
0.0		 2xkwB-1id1A:
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.
1ihm CAPSID PROTEIN

(Norwalk virus) 		PF00915
(Calici_coat)
PF08435
(Calici_coat_C) 		4 LEU A1113
ILE A1123
ILE A1128
LEU A1162
 None
 0.89A 2xkwB-1ihmA:
undetectable		 2xkwB-1ihmA:
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.
1kkh MEVALONATE KINASE

(Methanocaldococcus
jannaschii) 		PF00288
(GHMP_kinases_N)
PF08544
(GHMP_kinases_C) 		4 LEU A 233
ARG A  27
ILE A  29
ILE A 164
 None
 0.85A 2xkwB-1kkhA:
undetectable		 2xkwB-1kkhA:
22.32
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.
1mew INOSINE-5'-MONOPHOSP
HATE DEHYDROGENASE

(Tritrichomonas
suis) 		PF00478
(IMPDH)
PF00571
(CBS) 		4 LEU A 225
ILE A  48
ILE A 277
LEU A 250
 None
 0.87A 2xkwB-1mewA:
undetectable		 2xkwB-1mewA:
20.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1pjm IMPORTIN ALPHA-2
SUBUNIT

(Mus musculus) 		PF00514
(Arm)
PF16186
(Arm_3) 		4 LEU B 429
ILE B 444
ILE B 370
LEU B 382
 None
 0.84A 2xkwB-1pjmB:
undetectable		 2xkwB-1pjmB:
20.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1r8w GLYCEROL DEHYDRATASE

(Clostridium
butyricum) 		PF01228
(Gly_radical)
PF02901
(PFL-like) 		4 LEU A 242
ILE A  66
ILE A 273
LEU A 266
 None
 0.95A 2xkwB-1r8wA:
undetectable		 2xkwB-1r8wA:
17.98
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.
1soj CGMP-INHIBITED
3',5'-CYCLIC
PHOSPHODIESTERASE B

(Homo sapiens) 		PF00233
(PDEase_I) 		4 LEU A 895
ILE A 995
ILE A1071
LEU A 984
 None
 0.91A 2xkwB-1sojA:
undetectable		 2xkwB-1sojA:
22.45
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1t6t PUTATIVE PROTEIN

(Aquifex
aeolicus) 		PF01751
(Toprim) 		4 LEU 1   8
ILE 1 106
ILE 1  78
MET 1  82
 None
 0.90A 2xkwB-1t6t1:
undetectable		 2xkwB-1t6t1:
17.95
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.
1tk1 COPROPORPHYRINOGEN
III OXIDASE

(Saccharomyces
cerevisiae) 		PF01218
(Coprogen_oxidas) 		4 LEU A 178
ILE A 211
ILE A 120
LEU A 236
 None
 0.96A 2xkwB-1tk1A:
undetectable		 2xkwB-1tk1A:
19.11
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.
1tkl COPROPORPHYRINOGEN
III OXIDASE

(Saccharomyces
cerevisiae) 		PF01218
(Coprogen_oxidas) 		4 LEU A 178
ILE A 211
ILE A 120
LEU A 236
 None
 0.96A 2xkwB-1tklA:
undetectable		 2xkwB-1tklA:
19.65
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.
1wa5 IMPORTIN ALPHA
SUBUNIT

(Saccharomyces
cerevisiae) 		PF00514
(Arm)
PF01749
(IBB)
PF16186
(Arm_3) 		4 LEU B 350
ILE B 365
ILE B 292
LEU B 304
 None
 0.62A 2xkwB-1wa5B:
undetectable		 2xkwB-1wa5B:
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.
1wpq GLYCEROL-3-PHOSPHATE
DEHYDROGENASE
[NAD+], CYTOPLASMIC

(Homo sapiens) 		PF01210
(NAD_Gly3P_dh_N)
PF07479
(NAD_Gly3P_dh_C) 		4 LEU A 129
ILE A 199
ILE A 228
LEU A 321
 None
 0.80A 2xkwB-1wpqA:
undetectable		 2xkwB-1wpqA:
21.20
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.
1ye8 HYPOTHETICAL UPF0334
KINASE-LIKE PROTEIN
AQ_1292

(Aquifex
aeolicus) 		PF03266
(NTPase_1) 		4 LEU A 173
ARG A  23
ILE A  20
ILE A  87
 None
 0.93A 2xkwB-1ye8A:
undetectable		 2xkwB-1ye8A:
22.14
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.
1yw6 SUCCINYLGLUTAMATE
DESUCCINYLASE

(Escherichia
coli) 		PF04952
(AstE_AspA) 		4 LEU A 307
ARG A 151
ILE A 150
LEU A  91
 None
 0.90A 2xkwB-1yw6A:
undetectable		 2xkwB-1yw6A:
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.
1zbm HYPOTHETICAL PROTEIN
AF1704

(Archaeoglobus
fulgidus) 		PF02621
(VitK2_biosynth) 		4 LEU A  63
ILE A  55
ILE A 199
LEU A 192
 None
 0.89A 2xkwB-1zbmA:
undetectable		 2xkwB-1zbmA:
21.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1zkp HYPOTHETICAL PROTEIN
BA1088

(Bacillus
anthracis) 		PF12706
(Lactamase_B_2) 		4 LEU A  57
ILE A  68
ILE A  77
LEU A  85
 None
 0.90A 2xkwB-1zkpA:
undetectable		 2xkwB-1zkpA:
20.66
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.
1ztc HYPOTHETICAL PROTEIN
TM0894

(Thermotoga
maritima) 		PF00753
(Lactamase_B) 		4 LEU A 194
ILE A   5
ILE A  62
LEU A  66
 None
 0.93A 2xkwB-1ztcA:
undetectable		 2xkwB-1ztcA:
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.
2dg2 APOLIPOPROTEIN A-I
BINDING PROTEIN

(Mus musculus) 		PF03853
(YjeF_N) 		4 LEU A 174
ILE A 157
ILE A 133
LEU A 136
 None
 0.90A 2xkwB-2dg2A:
undetectable		 2xkwB-2dg2A:
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.
2f1k PREPHENATE
DEHYDROGENASE

(Synechocystis
sp. PCC 6803) 		PF02153
(PDH) 		4 LEU A  19
ILE A  60
ILE A  78
LEU A  52
 None
 0.93A 2xkwB-2f1kA:
undetectable		 2xkwB-2f1kA:
23.78
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.
2gh8 CAPSID PROTEIN

(Vesicular
exanthema of
swine virus) 		PF00915
(Calici_coat) 		4 LEU A 592
ARG A 398
ILE A 374
LEU A 634
 None
 0.76A 2xkwB-2gh8A:
undetectable		 2xkwB-2gh8A:
18.44
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2gno DNA POLYMERASE III,
GAMMA
SUBUNIT-RELATED
PROTEIN

(Thermotoga
maritima) 		PF13177
(DNA_pol3_delta2) 		4 LEU A  16
ILE A  28
ILE A  74
LEU A  60
 None
 0.91A 2xkwB-2gnoA:
undetectable		 2xkwB-2gnoA:
22.70
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.
2h3g BIOSYNTHETIC PROTEIN

(Bacillus
anthracis) 		PF03309
(Pan_kinase) 		4 LEU X  86
ILE X  92
ILE X 139
LEU X 241
 None
 0.96A 2xkwB-2h3gX:
undetectable		 2xkwB-2h3gX:
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.
2iex DIHYDROXYNAPTHOIC
ACID SYNTHETASE

(Geobacillus
kaustophilus) 		PF00378
(ECH_1) 		4 LEU A 197
ILE A 132
ILE A 216
LEU A 209
 None
 0.84A 2xkwB-2iexA:
undetectable		 2xkwB-2iexA:
22.44
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2jdx PROTEIN
(L-ARGININE:GLYCINE
AMIDINOTRANSFERASE)

(Homo sapiens) 		no annotation 4 ARG A 142
ILE A  79
ILE A 395
LEU A 401
 None
 0.96A 2xkwB-2jdxA:
undetectable		 2xkwB-2jdxA:
22.03
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.
2jgv TAGATOSE-6-PHOSPHATE
KINASE

(Staphylococcus
aureus) 		PF00294
(PfkB) 		4 LEU A 173
ILE A 182
ILE A   2
LEU A   5
 None
 0.90A 2xkwB-2jgvA:
undetectable		 2xkwB-2jgvA:
22.57
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.
2nvu MALTOSE BINDING
PROTEIN/NEDD8-ACTIVA
TING ENZYME E1
CATALYTIC SUBUNIT
CHIMERA

(Homo sapiens) 		PF00899
(ThiF)
PF08825
(E2_bind)
PF13416
(SBP_bac_8) 		4 LEU B1248
ILE B1227
ILE B1349
LEU B1193
 None
 0.95A 2xkwB-2nvuB:
undetectable		 2xkwB-2nvuB:
15.76
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.
2o8v PHOSPHOADENOSINE
PHOSPHOSULFATE
REDUCTASE

(Escherichia
coli) 		PF01507
(PAPS_reduct) 		4 LEU A  41
ARG A  69
ILE A  68
ILE A 190
 None
 0.95A 2xkwB-2o8vA:
undetectable		 2xkwB-2o8vA:
23.96
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2p54 PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR ALPHA

(Homo sapiens) 		PF00104
(Hormone_recep) 		5 LEU A 247
ARG A 271
ILE A 272
ILE A 317
MET A 320
 None
None
735  A 469 ( 4.2A)
735  A 469 ( 4.8A)
None
 0.84A 2xkwB-2p54A:
34.0		 2xkwB-2p54A:
61.94
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.
2pb9 PHOSPHOMETHYLPYRIMID
INE KINASE

(Pyrococcus
furiosus) 		PF10120
(ThiP_synth) 		4 ARG A 271
ILE A 272
ILE A 321
LEU A 342
 None
None
None
PO4  A 500 (-4.5A)
 0.97A 2xkwB-2pb9A:
undetectable		 2xkwB-2pb9A:
20.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2pq6 UDP-GLUCURONOSYL/UDP
-GLUCOSYLTRANSFERASE

(Medicago
truncatula) 		PF00201
(UDPGT) 		4 LEU A 313
ILE A 331
ILE A 372
LEU A 395
 None
 0.97A 2xkwB-2pq6A:
undetectable		 2xkwB-2pq6A:
20.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2pyw UNCHARACTERIZED
PROTEIN

(Arabidopsis
thaliana) 		PF01636
(APH) 		4 LEU A 151
ILE A 268
ILE A 299
LEU A 139
 None
 0.91A 2xkwB-2pywA:
undetectable		 2xkwB-2pywA:
20.14
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.
2qjo BIFUNCTIONAL NMN
ADENYLYLTRANSFERASE/
NUDIX HYDROLASE

(Synechocystis
sp. PCC 6803) 		PF00293
(NUDIX)
PF01467
(CTP_transf_like) 		4 LEU A 317
ILE A 332
ILE A 266
LEU A 292
 None
 0.97A 2xkwB-2qjoA:
undetectable		 2xkwB-2qjoA:
23.24
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.
2qr7 RIBOSOMAL PROTEIN S6
KINASE ALPHA-3

(Mus musculus) 		PF00069
(Pkinase) 		4 LEU A 530
ILE A 559
ILE A 505
LEU A 608
 None
 0.81A 2xkwB-2qr7A:
undetectable		 2xkwB-2qr7A:
24.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2qve TYROSINE AMINOMUTASE

(Streptomyces
globisporus) 		PF00221
(Lyase_aromatic) 		4 LEU A 166
ILE A 128
ILE A  62
LEU A  85
 None
 0.85A 2xkwB-2qveA:
undetectable		 2xkwB-2qveA:
21.32
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.
2qx0 7,8-DIHYDRO-6-HYDROX
YMETHYLPTERIN-PYROPH
OSPHOKINASE

(Yersinia pestis) 		PF01288
(HPPK) 		4 LEU A  71
ILE A  99
ILE A 132
LEU A  34
 None
APC  A 171 (-4.1A)
CSO  A  37 ( 4.6A)
CSO  A  37 ( 4.3A)
 0.95A 2xkwB-2qx0A:
undetectable		 2xkwB-2qx0A:
20.86
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.
2r98 PUTATIVE
ACETYLGLUTAMATE
SYNTHASE

(Neisseria
gonorrhoeae) 		PF00583
(Acetyltransf_1)
PF00696
(AA_kinase) 		4 LEU A 222
ARG A 213
ILE A 211
LEU A 205
 None
 0.97A 2xkwB-2r98A:
undetectable		 2xkwB-2r98A:
20.31
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.
2rch CYTOCHROME P450 74A

(Arabidopsis
thaliana) 		PF00067
(p450) 		4 LEU A 285
ILE A 243
ILE A 257
LEU A 273
 None
 0.87A 2xkwB-2rchA:
undetectable		 2xkwB-2rchA:
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.
2uv8 FATTY ACID SYNTHASE
SUBUNIT BETA (FAS1)

(Saccharomyces
cerevisiae) 		PF00698
(Acyl_transf_1)
PF01575
(MaoC_dehydratas)
PF08354
(DUF1729)
PF13452
(MaoC_dehydrat_N)
PF16073
(SAT) 		4 ARG G 264
ILE G 455
ILE G 483
LEU G 443
 None
 0.96A 2xkwB-2uv8G:
undetectable		 2xkwB-2uv8G:
8.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2vdj HOMOSERINE
O-SUCCINYLTRANSFERAS
E

(Bacillus cereus) 		PF04204
(HTS) 		4 LEU A  54
ILE A 141
ILE A 202
LEU A 211
 None
 0.91A 2xkwB-2vdjA:
undetectable		 2xkwB-2vdjA:
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.
2vsi 2-C-METHYL-D-ERYTHRI
TOL 4-PHOSPHATE
CYTIDYLYLTRANSFERASE

(Streptococcus
pneumoniae) 		PF01128
(IspD) 		4 LEU A  33
ILE A   6
ILE A 127
LEU A 120
 None
 0.93A 2xkwB-2vsiA:
undetectable		 2xkwB-2vsiA:
23.86
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.
2wk2 CHITINASE A

(Serratia
marcescens) 		PF00704
(Glyco_hydro_18)
PF08329
(ChitinaseA_N) 		4 LEU A 235
ILE A 228
ILE A 312
LEU A 188
 None
 0.92A 2xkwB-2wk2A:
undetectable		 2xkwB-2wk2A:
19.12
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.
2wk2 CHITINASE A

(Serratia
marcescens) 		PF00704
(Glyco_hydro_18)
PF08329
(ChitinaseA_N) 		4 LEU A 235
ILE A 228
ILE A 312
LEU A 269
 None
 0.91A 2xkwB-2wk2A:
undetectable		 2xkwB-2wk2A:
19.12
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.
2wnt RIBOSOMAL PROTEIN S6
KINASE

(Homo sapiens) 		PF00069
(Pkinase) 		4 LEU A 526
ILE A 555
ILE A 501
LEU A 604
 None
 0.84A 2xkwB-2wntA:
undetectable		 2xkwB-2wntA:
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.
2wvg PYRUVATE
DECARBOXYLASE

(Zymomonas
mobilis) 		PF00205
(TPP_enzyme_M)
PF02775
(TPP_enzyme_C)
PF02776
(TPP_enzyme_N) 		4 LEU A  32
ILE A  97
ILE A 131
LEU A  78
 None
 0.98A 2xkwB-2wvgA:
undetectable		 2xkwB-2wvgA:
17.14
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.
2zqq METHYLGLUTACONYL-COA
HYDRATASE

(Homo sapiens) 		PF00378
(ECH_1) 		4 LEU A 107
ILE A  94
ILE A 254
LEU A 192
 None
 0.83A 2xkwB-2zqqA:
undetectable		 2xkwB-2zqqA:
23.87
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.
3a3c MALTOSE-BINDING
PERIPLASMIC PROTEIN,
LINKER,
MITOCHONDRIAL
INTERMEMBRANE SPACE
IMPORT AND ASSEMBLY
PROTEIN 40

(Escherichia
coli;
Saccharomyces
cerevisiae;
synthetic
construct) 		PF06747
(CHCH)
PF13416
(SBP_bac_8) 		4 LEU A 247
ILE A 226
ILE A 348
LEU A 192
 None
 0.96A 2xkwB-3a3cA:
undetectable		 2xkwB-3a3cA:
19.96
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.
3a9v 4-COUMARATE--COA
LIGASE

(Populus
tomentosa) 		PF00501
(AMP-binding)
PF13193
(AMP-binding_C) 		4 LEU A 198
ILE A 235
ILE A 254
LEU A 246
 None
 0.98A 2xkwB-3a9vA:
undetectable		 2xkwB-3a9vA:
20.70
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3any ETHANOLAMINE
AMMONIA-LYASE HEAVY
CHAIN
ETHANOLAMINE
AMMONIA-LYASE LIGHT
CHAIN

(Escherichia
coli) 		PF05985
(EutC)
PF06751
(EutB) 		4 ARG B  77
ILE A 400
ILE A 209
LEU A 225
 None
None
None
2A3  A 602 ( 4.6A)
 0.97A 2xkwB-3anyB:
undetectable		 2xkwB-3anyB:
22.37
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3b0q PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA

(Homo sapiens) 		PF00104
(Hormone_recep) 		5 LEU A 255
ARG A 280
ILE A 281
ILE A 326
MET A 329
 None
None
MC5  A   1 ( 4.8A)
MC5  A   1 ( 4.9A)
None
 0.65A 2xkwB-3b0qA:
37.2		 2xkwB-3b0qA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3b0q PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA

(Homo sapiens) 		PF00104
(Hormone_recep) 		5 LEU A 255
ILE A 281
ILE A 326
MET A 329
LEU A 333
 None
MC5  A   1 ( 4.8A)
MC5  A   1 ( 4.9A)
None
None
 0.28A 2xkwB-3b0qA:
37.2		 2xkwB-3b0qA:
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.
3bdz P450CIN

(Citrobacter
braakii) 		PF00067
(p450) 		4 LEU A 340
ARG A 354
ILE A 353
ILE A 155
 HEM  A 450 (-4.9A)
None
HEM  A 450 (-3.8A)
None
 0.84A 2xkwB-3bdzA:
undetectable		 2xkwB-3bdzA:
21.80
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.
3ber PROBABLE
ATP-DEPENDENT RNA
HELICASE DDX47

(Homo sapiens) 		PF00270
(DEAD) 		4 ARG A  62
ILE A  64
ILE A 145
LEU A  98
 None
 0.91A 2xkwB-3berA:
undetectable		 2xkwB-3berA:
23.91
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.
3byw PUTATIVE
ARABINOFURANOSYLTRAN
SFERASE

(Corynebacterium
diphtheriae) 		PF04602
(Arabinose_trans) 		4 LEU A 121
ILE A 135
ILE A 169
LEU A  83
 None
 0.90A 2xkwB-3bywA:
undetectable		 2xkwB-3bywA:
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.
3d7j UNCHARACTERIZED
PROTEIN SCO6650

(Streptomyces
coelicolor) 		PF01242
(PTPS) 		4 LEU A  66
ARG A  94
ILE A  91
ILE A   4
 None
 0.62A 2xkwB-3d7jA:
undetectable		 2xkwB-3d7jA:
18.68
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.
3dhw METHIONINE IMPORT
ATP-BINDING PROTEIN
METN

(Escherichia
coli) 		PF00005
(ABC_tran)
PF09383
(NIL) 		4 LEU C 127
ARG C 189
ILE C 186
ILE C   2
 None
 0.85A 2xkwB-3dhwC:
undetectable		 2xkwB-3dhwC:
22.71
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3dzu PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA

(Homo sapiens) 		PF00104
(Hormone_recep)
PF00105
(zf-C4) 		6 LEU D 255
ARG D 280
ILE D 281
ILE D 326
MET D 329
LEU D 333
 None
None
PLB  D 701 (-4.6A)
PLB  D 701 ( 4.5A)
None
PLB  D 701 (-4.4A)
 0.66A 2xkwB-3dzuD:
34.5		 2xkwB-3dzuD:
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.
3emq ENDO-1,4-BETA-XYLANA
SE

(Paenibacillus
barcinonensis) 		PF00331
(Glyco_hydro_10) 		4 LEU A 277
ARG A 224
ILE A 227
ILE A 136
 None
 0.90A 2xkwB-3emqA:
undetectable		 2xkwB-3emqA:
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.
3ewi N-ACYLNEURAMINATE
CYTIDYLYLTRANSFERASE

(Mus musculus) 		no annotation 4 LEU A  20
ILE A  45
ILE A 159
LEU A 120
 None
 0.75A 2xkwB-3ewiA:
undetectable		 2xkwB-3ewiA:
21.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ewm UNCHARACTERIZED
SUGAR KINASE PH1459

(Pyrococcus
horikoshii) 		PF00294
(PfkB) 		4 LEU A 199
ILE A 183
ILE A 257
LEU A 223
 None
 0.93A 2xkwB-3ewmA:
undetectable		 2xkwB-3ewmA:
23.24
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.
3fef PUTATIVE GLUCOSIDASE
LPLD,
ALPHA-GALACTURONIDAS
E

(Bacillus
subtilis) 		PF02056
(Glyco_hydro_4)
PF11975
(Glyco_hydro_4C) 		4 LEU A  30
ILE A 336
ILE A 167
LEU A  77
 None
 0.89A 2xkwB-3fefA:
undetectable		 2xkwB-3fefA:
19.87
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.
3fqd 5'-3'
EXORIBONUCLEASE 2

(Schizosaccharomyces
pombe) 		PF03159
(XRN_N) 		4 LEU A 319
ARG A 301
ILE A 346
LEU A 354
 None
 0.90A 2xkwB-3fqdA:
undetectable		 2xkwB-3fqdA:
15.02
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.
3hkz DNA-DIRECTED RNA
POLYMERASE SUBUNIT B

(Sulfolobus
solfataricus) 		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 LEU B 353
ILE B 394
ILE B  80
LEU B 123
 None
 0.92A 2xkwB-3hkzB:
undetectable		 2xkwB-3hkzB:
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.
3htz ALANYL-TRNA
SYNTHETASE

(Aquifex
aeolicus) 		PF01411
(tRNA-synt_2c) 		5 LEU A  77
ARG A 297
ILE A 298
ILE A 311
LEU A 266
 None
 1.31A 2xkwB-3htzA:
undetectable		 2xkwB-3htzA:
21.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3hxw ALANYL-TRNA
SYNTHETASE

(Escherichia
coli) 		PF01411
(tRNA-synt_2c) 		4 LEU A  77
ARG A 311
ILE A 312
LEU A 280
 None
 0.96A 2xkwB-3hxwA:
undetectable		 2xkwB-3hxwA:
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.
3iby FERROUS IRON
TRANSPORT PROTEIN B

(Legionella
pneumophila) 		PF02421
(FeoB_N) 		4 LEU A 100
ILE A  91
ILE A  52
LEU A  55
 None
 0.94A 2xkwB-3ibyA:
undetectable		 2xkwB-3ibyA:
24.66
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.
3ij3 CYTOSOL
AMINOPEPTIDASE

(Coxiella
burnetii) 		PF00883
(Peptidase_M17) 		4 LEU A 111
ILE A 146
ILE A 331
LEU A 373
 None
 0.97A 2xkwB-3ij3A:
undetectable		 2xkwB-3ij3A:
22.96
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.
3ij3 CYTOSOL
AMINOPEPTIDASE

(Coxiella
burnetii) 		PF00883
(Peptidase_M17) 		4 LEU A 207
ILE A 209
ILE A 331
LEU A 319
 None
 0.95A 2xkwB-3ij3A:
undetectable		 2xkwB-3ij3A:
22.96
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.
3il4 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
SYNTHASE 3

(Enterococcus
faecalis) 		PF08541
(ACP_syn_III_C)
PF08545
(ACP_syn_III) 		4 LEU A 301
ARG A  10
ILE A  11
LEU A 247
 None
 0.91A 2xkwB-3il4A:
undetectable		 2xkwB-3il4A:
24.36
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.
3j08 COPPER-EXPORTING
P-TYPE ATPASE A

(Archaeoglobus
fulgidus) 		PF00122
(E1-E2_ATPase)
PF00702
(Hydrolase) 		4 LEU A 521
ILE A 533
ILE A 455
LEU A 450
 None
 0.89A 2xkwB-3j08A:
undetectable		 2xkwB-3j08A:
19.41
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.
3j09 COPPER-EXPORTING
P-TYPE ATPASE A

(Archaeoglobus
fulgidus) 		PF00122
(E1-E2_ATPase)
PF00403
(HMA)
PF00702
(Hydrolase) 		4 LEU A 521
ILE A 533
ILE A 455
LEU A 450
 None
 0.94A 2xkwB-3j09A:
undetectable		 2xkwB-3j09A:
17.47
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.
3k9t PUTATIVE PEPTIDASE

(Clostridium
acetobutylicum) 		PF09940
(DUF2172)
PF16221
(HTH_47)
PF16254
(DUF4910) 		4 LEU A  25
ILE A  44
ILE A 173
LEU A 183
 None
 0.98A 2xkwB-3k9tA:
undetectable		 2xkwB-3k9tA:
21.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ke6 PROTEIN
RV1364C/MT1410

(Mycobacterium
tuberculosis) 		PF07228
(SpoIIE)
PF13581
(HATPase_c_2) 		4 LEU A 205
ILE A 178
ILE A 352
LEU A 285
 None
 0.95A 2xkwB-3ke6A:
undetectable		 2xkwB-3ke6A:
18.93
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.
3kjx TRANSCRIPTIONAL
REGULATOR, LACI
FAMILY

(Ruegeria
pomeroyi) 		PF00356
(LacI)
PF00532
(Peripla_BP_1) 		4 LEU A 240
ILE A 275
ILE A 332
MET A 296
 None
 0.93A 2xkwB-3kjxA:
undetectable		 2xkwB-3kjxA:
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.
3kmv ALPHA-L-ARABINOFURAN
OSIDASE B

(Ruminiclostridium
thermocellum) 		PF05270
(AbfB) 		4 ARG A  31
ILE A  32
ILE A  96
LEU A 100
 None
 0.90A 2xkwB-3kmvA:
undetectable		 2xkwB-3kmvA:
19.42
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.
3ljp CHOLINE OXIDASE

(Arthrobacter
globiformis) 		PF00732
(GMC_oxred_N)
PF05199
(GMC_oxred_C) 		4 LEU A 226
ARG A  50
ILE A 215
ILE A 513
 None
 0.84A 2xkwB-3ljpA:
undetectable		 2xkwB-3ljpA:
17.34
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.
3lq1 2-SUCCINYL-5-ENOLPYR
UVYL-6-HYDROXY-3-CYC
LOHEXENE-1-CARBOXYLA
TE SYNTHASE

(Listeria
monocytogenes) 		PF02775
(TPP_enzyme_C)
PF02776
(TPP_enzyme_N)
PF16582
(TPP_enzyme_M_2) 		4 LEU A 469
ILE A 481
ILE A 425
LEU A 428
 None
 0.74A 2xkwB-3lq1A:
undetectable		 2xkwB-3lq1A:
17.65
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.
3lun ULILYSIN

(Methanosarcina
acetivorans) 		PF05572
(Peptidase_M43) 		5 LEU A 171
ARG A 317
ILE A 230
ILE A 116
LEU A 101
 None
 1.29A 2xkwB-3lunA:
undetectable		 2xkwB-3lunA:
19.54
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.
3m1t PUTATIVE
PHOSPHOHYDROLASE

(Shewanella
amazonensis) 		PF08668
(HDOD) 		4 LEU A 239
ILE A 223
ILE A 135
LEU A 213
 None
 0.96A 2xkwB-3m1tA:
undetectable		 2xkwB-3m1tA:
25.82
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.
3mq9 BONE MARROW STROMAL
ANTIGEN 2 FUSED TO
MALTOSE-BINDING
PERIPLASMIC PROTEIN

(Escherichia
coli;
Homo sapiens) 		PF13416
(SBP_bac_8)
PF16716
(BST2) 		4 LEU A 247
ILE A 226
ILE A 348
LEU A 192
 None
 0.96A 2xkwB-3mq9A:
undetectable		 2xkwB-3mq9A:
19.83
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.
3n53 RESPONSE REGULATOR
RECEIVER MODULATED
DIGUANYLATE CYCLASE

(Pelobacter
carbinolicus) 		PF00072
(Response_reg) 		4 LEU A 118
ILE A   4
ILE A  54
LEU A  79
 None
 0.92A 2xkwB-3n53A:
undetectable		 2xkwB-3n53A:
20.45
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.
3no2 UNCHARACTERIZED
PROTEIN

(Bacteroides
caccae) 		no annotation 4 LEU A 277
ILE A  38
ILE A  79
LEU A  51
 None
 0.92A 2xkwB-3no2A:
undetectable		 2xkwB-3no2A:
22.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3oks 4-AMINOBUTYRATE
TRANSAMINASE

(Mycolicibacterium
smegmatis) 		PF00202
(Aminotran_3) 		4 LEU A 444
ARG A 368
ILE A 369
ILE A 239
 None
 0.89A 2xkwB-3oksA:
undetectable		 2xkwB-3oksA:
22.44
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3opy 6-PHOSPHOFRUCTO-1-KI
NASE BETA-SUBUNIT
6-PHOSPHOFRUCTO-1-KI
NASE GAMMA-SUBUNIT

(Komagataella
pastoris) 		PF00365
(PFK)
no annotation 		4 LEU B 759
ILE B 931
ILE I 296
LEU I 350
 None
 0.96A 2xkwB-3opyB:
undetectable		 2xkwB-3opyB:
16.04
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.
3orw PHOSPHOTRIESTERASE

(Geobacillus
kaustophilus) 		PF02126
(PTE) 		4 LEU A  90
ILE A  63
ILE A 261
LEU A 323
 None
 0.87A 2xkwB-3orwA:
undetectable		 2xkwB-3orwA:
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.
3ovk AMINOPEPTIDASE P,
XAA-PRO DIPEPTIDASE

(Streptococcus
pyogenes) 		PF01321
(Creatinase_N) 		4 LEU A  35
ILE A  47
ILE A 116
LEU A  80
 None
 0.97A 2xkwB-3ovkA:
undetectable		 2xkwB-3ovkA:
19.27
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.
3p1t PUTATIVE
HISTIDINOL-PHOSPHATE
AMINOTRANSFERASE

(Burkholderia
pseudomallei) 		PF00155
(Aminotran_1_2) 		4 LEU A 156
ARG A 181
ILE A 168
ILE A 216
 None
 0.95A 2xkwB-3p1tA:
undetectable		 2xkwB-3p1tA:
24.23
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.
3p27 ELONGATION FACTOR 1
ALPHA-LIKE PROTEIN

(Saccharomyces
cerevisiae) 		PF00009
(GTP_EFTU)
PF03143
(GTP_EFTU_D3) 		4 LEU A 377
ILE A 273
ILE A 339
LEU A 333
 None
 0.95A 2xkwB-3p27A:
undetectable		 2xkwB-3p27A:
19.96
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.
3pko GERANYLGERANYL
PYROPHOSPHATE
SYNTHASE

(Lactobacillus
brevis) 		PF00348
(polyprenyl_synt) 		4 ARG A 159
ILE A 162
ILE A 270
LEU A 276
 None
 0.97A 2xkwB-3pkoA:
2.2		 2xkwB-3pkoA:
23.73
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.
3pr2 TRYPTOPHAN SYNTHASE
ALPHA CHAIN

(Salmonella
enterica) 		PF00290
(Trp_syntA) 		4 ARG A 188
ILE A 214
ILE A 153
LEU A 100
 None
None
F9F  A   1 (-4.3A)
F9F  A   1 (-3.6A)
 0.98A 2xkwB-3pr2A:
undetectable		 2xkwB-3pr2A:
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.
3pr6 TRAPP-ASSOCIATED
PROTEIN TCA17

(Saccharomyces
cerevisiae) 		PF04628
(Sedlin_N) 		4 LEU A   3
ILE A 105
ILE A  79
LEU A  10
 None
None
CL  A 158 ( 4.5A)
None
 0.96A 2xkwB-3pr6A:
undetectable		 2xkwB-3pr6A:
22.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3sut BETA-HEXOSAMINIDASE

(Paenibacillus
sp. TS12) 		PF00728
(Glyco_hydro_20)
PF02838
(Glyco_hydro_20b) 		4 LEU A 459
ILE A 190
ILE A  56
LEU A 128
 None
 0.95A 2xkwB-3sutA:
undetectable		 2xkwB-3sutA:
20.60
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.
3tc9 HYPOTHETICAL
HYDROLASE

(Bacteroides
thetaiotaomicron) 		PF01833
(TIG) 		4 LEU A 333
ILE A 302
ILE A 222
LEU A 249
 None
 0.76A 2xkwB-3tc9A:
undetectable		 2xkwB-3tc9A:
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.
3trc PHOSPHOENOLPYRUVATE-
PROTEIN
PHOSPHOTRANSFERASE

(Coxiella
burnetii) 		PF01590
(GAF) 		4 LEU A 165
ILE A  44
ILE A 129
LEU A 148
 None
 0.98A 2xkwB-3trcA:
undetectable		 2xkwB-3trcA:
22.10