SIMILAR PATTERNS OF AMINO ACIDS FOR 4HXY_B_ACAB502

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.
1bev BOVINE ENTEROVIRUS
COAT PROTEINS VP1 TO
VP4

(Enterovirus E) 		PF00073
(Rhv) 		4 VAL 3 166
SER 1  47
GLN 3 221
MET 1  54
 None
 1.18A 4hxyB-1bev3:
undetectable		 4hxyB-1bev3:
20.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1cqq TYPE 2 RHINOVIRUS 3C
PROTEASE

(Rhinovirus A) 		PF00548
(Peptidase_C3) 		4 VAL A 116
SER A 171
TYR A 138
LEU A 104
 None
 1.20A 4hxyB-1cqqA:
undetectable		 4hxyB-1cqqA:
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.
1cyd CARBONYL REDUCTASE

(Mus musculus) 		PF13561
(adh_short_C2) 		4 VAL A  87
SER A 136
TYR A 149
MET A 186
 None
IPA  A 246 ( 2.7A)
IPA  A 246 ( 4.4A)
NDP  A 245 (-3.6A)
 0.40A 4hxyB-1cydA:
19.2		 4hxyB-1cydA:
21.31
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1e6w SHORT CHAIN
3-HYDROXYACYL-COA
DEHYDROGENASE

(Rattus
norvegicus) 		PF00106
(adh_short) 		4 SER A 155
GLN A 165
TYR A 168
LEU A 206
 NAD  A 301 ( 3.9A)
None
NAD  A 301 (-4.5A)
NAD  A 301 (-3.9A)
 0.57A 4hxyB-1e6wA:
19.7		 4hxyB-1e6wA:
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.
1g0n TRIHYDROXYNAPHTHALEN
E REDUCTASE

(Magnaporthe
grisea) 		PF13561
(adh_short_C2) 		4 VAL A 118
SER A 164
TYR A 178
MET A 215
 None
PHH  A 402 (-2.2A)
PHH  A 402 ( 4.0A)
PHH  A 402 ( 3.3A)
 0.54A 4hxyB-1g0nA:
19.1		 4hxyB-1g0nA:
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.
1iy8 LEVODIONE REDUCTASE

(Leifsonia
aquatica) 		PF13561
(adh_short_C2) 		4 SER A 152
GLN A 162
TYR A 165
MET A 202
 NAD  A1268 (-2.5A)
MRD  A1269 (-3.7A)
MRD  A1269 ( 3.9A)
NAD  A1268 (-3.5A)
 0.62A 4hxyB-1iy8A:
19.7		 4hxyB-1iy8A:
22.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1jk0 RIBONUCLEOSIDE-DIPHO
SPHATE REDUCTASE
SMALL CHAIN 2

(Saccharomyces
cerevisiae) 		PF00268
(Ribonuc_red_sm) 		4 SER B 227
GLN B 120
TYR B 117
LEU B 100
 None
 1.15A 4hxyB-1jk0B:
undetectable		 4hxyB-1jk0B:
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.
1k8i MHC CLASS II H2-M
BETA 2 CHAIN

(Mus musculus) 		PF00969
(MHC_II_beta)
PF07654
(C1-set) 		4 VAL B 174
GLN B 176
MET B 131
LEU B 136
 None
 1.11A 4hxyB-1k8iB:
undetectable		 4hxyB-1k8iB:
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.
1kb0 QUINOHEMOPROTEIN
ALCOHOL
DEHYDROGENASE

(Comamonas
testosteroni) 		PF13360
(PQQ_2)
PF13442
(Cytochrome_CBB3) 		4 VAL A 529
SER A 536
TYR A 527
ASP A  93
 None
 0.97A 4hxyB-1kb0A:
undetectable		 4hxyB-1kb0A:
23.16
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.
1kol FORMALDEHYDE
DEHYDROGENASE

(Pseudomonas
putida) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		4 VAL A 262
SER A 285
LEU A 218
ASP A 217
 NAD  A1403 (-3.6A)
None
None
NAD  A1403 (-2.9A)
 1.14A 4hxyB-1kolA:
undetectable		 4hxyB-1kolA:
25.42
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.
1m0v PROTEIN-TYROSINE
PHOSPHATASE YOPH

(Yersinia
pseudotuberculosis) 		PF09013
(YopH_N) 		4 VAL A  63
SER A 102
LEU A  68
ASP A  72
 None
 0.98A 4hxyB-1m0vA:
undetectable		 4hxyB-1m0vA:
15.49
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.
1pc3 PHOSPHATE-BINDING
PROTEIN 1

(Mycobacterium
tuberculosis) 		PF12849
(PBP_like_2) 		4 SER A 166
GLN A 107
TYR A 224
MET A 211
 PO4  A1352 (-2.8A)
None
None
None
 1.25A 4hxyB-1pc3A:
undetectable		 4hxyB-1pc3A:
24.21
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.
1vkn N-ACETYL-GAMMA-GLUTA
MYL-PHOSPHATE
REDUCTASE

(Thermotoga
maritima) 		PF01118
(Semialdhyde_dh)
PF02774
(Semialdhyde_dhC) 		4 VAL A  63
SER A  33
TYR A  31
LEU A  82
 None
 0.91A 4hxyB-1vknA:
undetectable		 4hxyB-1vknA:
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.
1wkb LEUCYL-TRNA
SYNTHETASE

(Pyrococcus
horikoshii) 		PF00133
(tRNA-synt_1)
PF08264
(Anticodon_1) 		4 VAL A 753
GLN A 754
TYR A 758
LEU A 680
 None
 1.24A 4hxyB-1wkbA:
undetectable		 4hxyB-1wkbA:
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.
1z1e STILBENE SYNTHASE

(Arachis
hypogaea) 		PF00195
(Chal_sti_synt_N)
PF02797
(Chal_sti_synt_C) 		4 VAL A  31
GLN A  33
TYR A  36
MET A  70
 None
 1.08A 4hxyB-1z1eA:
undetectable		 4hxyB-1z1eA:
21.14
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.
2bhm TYPE IV SECRETION
SYSTEM PROTEIN VIRB8

(Brucella suis) 		PF04335
(VirB8) 		4 GLN A 144
TYR A 141
LEU A 122
ASP A 152
 None
 1.01A 4hxyB-2bhmA:
undetectable		 4hxyB-2bhmA:
15.14
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.
2dt7 SPLICING FACTOR 3
SUBUNIT 1

(Homo sapiens) 		PF01805
(Surp) 		4 VAL B 166
SER B 160
GLN B 194
LEU B 204
 None
 1.24A 4hxyB-2dt7B:
undetectable		 4hxyB-2dt7B:
9.40
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.
2g18 PHYCOCYANOBILIN:FERR
EDOXIN
OXIDOREDUCTASE

(Anabaena sp.) 		PF05996
(Fe_bilin_red) 		4 SER A 118
GLN A 213
TYR A 209
ASP A 102
 None
 1.11A 4hxyB-2g18A:
undetectable		 4hxyB-2g18A:
18.58
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.
2gdz NAD+-DEPENDENT
15-HYDROXYPROSTAGLAN
DIN DEHYDROGENASE

(Homo sapiens) 		PF00106
(adh_short) 		4 SER A 138
GLN A 148
TYR A 151
LEU A 191
 NAD  A 300 (-3.5A)
None
NAD  A 300 (-4.5A)
NAD  A 300 ( 4.4A)
 0.90A 4hxyB-2gdzA:
18.6		 4hxyB-2gdzA:
20.50
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.
2i2x METHYLTRANSFERASE 1

(Methanosarcina
barkeri) 		PF12176
(MtaB) 		4 VAL A 101
GLN A 105
TYR A  62
MET A  91
 None
 1.24A 4hxyB-2i2xA:
undetectable		 4hxyB-2i2xA:
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.
2joe HYPOTHETICAL
LIPOPROTEIN YEHR

(Escherichia
coli) 		PF06998
(DUF1307) 		4 VAL A  30
TYR A  23
MET A 115
ASP A 108
 None
 1.20A 4hxyB-2joeA:
undetectable		 4hxyB-2joeA:
13.38
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.
2pce PUTATIVE MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME

(Roseovarius
nubinhibens) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		4 VAL A 360
SER A 303
LEU A 356
ASP A 111
 None
 1.00A 4hxyB-2pceA:
undetectable		 4hxyB-2pceA:
23.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2pfy PUTATIVE EXPORTED
PROTEIN

(Bordetella
pertussis) 		PF03480
(DctP) 		4 VAL A 196
SER A 190
TYR A 195
LEU A 255
 None
 1.21A 4hxyB-2pfyA:
undetectable		 4hxyB-2pfyA:
24.15
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2qlv NUCLEAR PROTEIN SNF4

(Saccharomyces
cerevisiae) 		PF00571
(CBS) 		4 VAL C  11
SER C 281
GLN C  15
ASP C 190
 None
 1.21A 4hxyB-2qlvC:
undetectable		 4hxyB-2qlvC:
21.79
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.
2qwz PHENYLACETIC ACID
DEGRADATION-RELATED
PROTEIN

(Ruegeria sp.
TM1040) 		PF03061
(4HBT) 		4 VAL A  52
SER A 120
MET A  57
LEU A  60
 ACT  A 141 ( 4.0A)
None
None
None
 1.20A 4hxyB-2qwzA:
undetectable		 4hxyB-2qwzA:
17.16
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.
2xa7 ADAPTOR-RELATED
PROTEIN COMPLEX 2,
ALPHA 2 SUBUNIT

(Rattus
norvegicus) 		PF01602
(Adaptin_N) 		4 VAL A 390
GLN A 387
MET A 409
LEU A 413
 None
 1.07A 4hxyB-2xa7A:
undetectable		 4hxyB-2xa7A:
21.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2yln PUTATIVE ABC
TRANSPORTER,
PERIPLASMIC BINDING
PROTEIN, AMINO ACID

(Neisseria
gonorrhoeae) 		PF00497
(SBP_bac_3) 		4 VAL A 181
SER A 165
GLN A 161
LEU A 184
 None
CYS  A 600 ( 4.1A)
None
CYS  A 600 (-4.3A)
 1.22A 4hxyB-2ylnA:
undetectable		 4hxyB-2ylnA:
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.
2yx0 RADICAL SAM ENZYME

(Pyrococcus
horikoshii) 		PF04055
(Radical_SAM)
PF08608
(Wyosine_form) 		4 VAL A 240
GLN A 197
TYR A 199
LEU A 322
 None
 1.19A 4hxyB-2yx0A:
undetectable		 4hxyB-2yx0A:
21.24
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.
3acf BETA-1,4-ENDOGLUCANA
SE

([Clostridium]
josui) 		PF03424
(CBM_17_28) 		4 VAL A  67
TYR A  69
MET A 195
LEU A 105
 None
 1.06A 4hxyB-3acfA:
undetectable		 4hxyB-3acfA:
18.76
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.
3au0 CLUMPING FACTOR B

(Staphylococcus
aureus) 		PF10425
(SdrG_C_C) 		4 SER A 375
GLN A 377
TYR A 446
ASP A 232
 None
 1.11A 4hxyB-3au0A:
undetectable		 4hxyB-3au0A:
19.18
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.
3e0l GUANINE DEAMINASE

(Homo sapiens) 		PF01979
(Amidohydro_1) 		4 VAL A 216
SER A 237
MET A 221
LEU A 224
 None
 1.25A 4hxyB-3e0lA:
undetectable		 4hxyB-3e0lA:
21.33
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3fah ALDEHYDE
OXIDOREDUCTASE

(Desulfovibrio
gigas) 		PF00111
(Fer2)
PF01315
(Ald_Xan_dh_C)
PF01799
(Fer2_2)
PF02738
(Ald_Xan_dh_C2) 		4 SER A 429
TYR A 448
MET A 212
LEU A 284
 None
 1.25A 4hxyB-3fahA:
undetectable		 4hxyB-3fahA:
20.26
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.
3gg0 KLEBSIELLA
PNEUMONIAE BLRP1

(Klebsiella
pneumoniae) 		PF00563
(EAL)
PF04940
(BLUF) 		4 VAL A 357
SER A 186
GLN A 379
ASP A 302
 None
None
None
MN  A 503 (-2.5A)
 1.09A 4hxyB-3gg0A:
undetectable		 4hxyB-3gg0A:
23.79
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.
3gnn NICOTINATE-NUCLEOTID
E PYROPHOSPHORYLASE

(Burkholderia
pseudomallei) 		PF01729
(QRPTase_C)
PF02749
(QRPTase_N) 		4 VAL A  59
SER A 125
TYR A 288
MET A  94
 None
 1.24A 4hxyB-3gnnA:
undetectable		 4hxyB-3gnnA:
22.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3gvc PROBABLE SHORT-CHAIN
TYPE
DEHYDROGENASE/REDUCT
ASE

(Mycobacterium
tuberculosis) 		PF13561
(adh_short_C2) 		4 VAL A 114
SER A 162
TYR A 175
MET A 212
 None
 0.70A 4hxyB-3gvcA:
19.9		 4hxyB-3gvcA:
23.76
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.
3hqi SPECKLE-TYPE POZ
PROTEIN

(Homo sapiens) 		PF00651
(BTB)
PF00917
(MATH) 		4 VAL A 163
GLN A 165
LEU A  65
ASP A  63
 None
 1.25A 4hxyB-3hqiA:
undetectable		 4hxyB-3hqiA:
19.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3nd0 SLL0855 PROTEIN

(Synechocystis
sp. PCC 6803) 		PF00654
(Voltage_CLC) 		4 VAL A 394
SER A 103
TYR A 437
LEU A 194
 None
CL  A 467 (-2.7A)
None
None
 1.18A 4hxyB-3nd0A:
undetectable		 4hxyB-3nd0A:
25.54
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.
3o3m BETA SUBUNIT
2-HYDROXYACYL-COA
DEHYDRATASE

(Clostridioides
difficile) 		PF06050
(HGD-D) 		4 SER B  73
GLN B  57
LEU B 238
ASP B 240
 None
 1.17A 4hxyB-3o3mB:
undetectable		 4hxyB-3o3mB:
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.
3ob8 BETA-GALACTOSIDASE

(Kluyveromyces
lactis) 		PF00703
(Glyco_hydro_2)
PF02836
(Glyco_hydro_2_C)
PF02837
(Glyco_hydro_2_N)
PF02929
(Bgal_small_N) 		4 VAL A 163
SER A 119
GLN A 160
LEU A 200
 None
 1.17A 4hxyB-3ob8A:
undetectable		 4hxyB-3ob8A:
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.
3oc9 UDP-N-ACETYLGLUCOSAM
INE
PYROPHOSPHORYLASE

(Entamoeba
histolytica) 		PF01704
(UDPGP) 		4 VAL A  15
SER A 319
TYR A 197
ASP A 191
 None
 1.10A 4hxyB-3oc9A:
undetectable		 4hxyB-3oc9A:
19.36
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.
3oec CARVEOL
DEHYDROGENASE
(MYTHA.01326.C,
A0R518 HOMOLOG)

(Mycolicibacterium
thermoresistibile) 		PF13561
(adh_short_C2) 		4 SER A 173
GLN A 183
TYR A 186
MET A 223
 None
 0.84A 4hxyB-3oecA:
19.5		 4hxyB-3oecA:
23.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3qlj SHORT CHAIN
DEHYDROGENASE

(Mycobacterium
avium) 		PF00106
(adh_short) 		4 VAL A 104
SER A 158
GLN A 168
TYR A 171
 CL  A 302 ( 4.8A)
None
None
None
 0.65A 4hxyB-3qljA:
17.2		 4hxyB-3qljA:
25.39
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.
3r08 MOUSE ANTI-MOUSE
CD3EPSILON ANTIBODY
2C11 LIGHT CHAIN

(Cricetulus
migratorius) 		PF07654
(C1-set)
PF07686
(V-set) 		4 VAL L 150
TYR L 192
LEU L 181
ASP L 185
 None
 1.25A 4hxyB-3r08L:
undetectable		 4hxyB-3r08L:
17.93
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.
3rfy PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE
CYP38, CHLOROPLASTIC

(Arabidopsis
thaliana) 		PF00160
(Pro_isomerase) 		4 VAL A 278
SER A  92
TYR A 283
LEU A 262
 None
 0.90A 4hxyB-3rfyA:
undetectable		 4hxyB-3rfyA:
20.13
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.
3rqi RESPONSE REGULATOR
PROTEIN

(Burkholderia
pseudomallei) 		PF00072
(Response_reg)
PF02954
(HTH_8) 		4 VAL A  80
SER A  86
TYR A 101
LEU A  63
 None
SO4  A 184 (-4.9A)
None
None
 1.11A 4hxyB-3rqiA:
4.8		 4hxyB-3rqiA:
19.18
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.
3tsc PUTATIVE
OXIDOREDUCTASE

(Mycobacterium
avium) 		PF13561
(adh_short_C2) 		4 SER A 157
GLN A 164
TYR A 170
MET A 207
 NAD  A 274 (-3.6A)
None
NAD  A 274 (-4.9A)
NAD  A 274 (-3.6A)
 1.06A 4hxyB-3tscA:
19.4		 4hxyB-3tscA:
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.
3wd7 TYPE III POLYKETIDE
SYNTHASES ACRIDONE
SYNTHASE

(Citrus x
microcarpa) 		PF00195
(Chal_sti_synt_N)
PF02797
(Chal_sti_synt_C) 		4 VAL A  31
GLN A  33
TYR A  36
MET A  70
 VAL  A  31 ( 0.6A)
GLN  A  33 ( 0.6A)
TYR  A  36 ( 1.3A)
MET  A  70 ( 0.0A)
 1.16A 4hxyB-3wd7A:
undetectable		 4hxyB-3wd7A:
20.96
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.
3wuy NITRILASE

(Synechocystis
sp. PCC 6803) 		PF00795
(CN_hydrolase) 		4 SER A  63
TYR A  59
MET A 197
LEU A 246
 None
 1.22A 4hxyB-3wuyA:
undetectable		 4hxyB-3wuyA:
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.
3zxs CRYPTOCHROME B

(Rhodobacter
sphaeroides) 		PF04244
(DPRP) 		4 GLN A 353
TYR A 359
LEU A 259
ASP A 256
 None
FAD  A1509 (-4.6A)
None
None
 1.20A 4hxyB-3zxsA:
undetectable		 4hxyB-3zxsA:
23.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4aip FE-REGULATED PROTEIN
B

(Neisseria
meningitidis) 		PF00593
(TonB_dep_Rec)
PF07715
(Plug) 		4 VAL A 730
SER A 244
TYR A 226
ASP A  84
 None
 1.24A 4hxyB-4aipA:
undetectable		 4hxyB-4aipA:
21.58
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.
4akz TYPE IV SECRETION
SYSTEM PROTEIN VIRB8

(Brucella suis) 		PF04335
(VirB8) 		4 GLN A 144
TYR A 141
LEU A 122
ASP A 152
 None
 1.00A 4hxyB-4akzA:
undetectable		 4hxyB-4akzA:
12.90
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.
4apq MOUSE NKT TCR
AUTOREACTIVE-VBETA6,
HUMAN NKT TCR
AUTOREACTIVE-VBETA6

(Mus musculus) 		PF07654
(C1-set)
PF07686
(V-set) 		4 VAL D 117
GLN D  14
LEU D 220
ASP D 224
 None
 1.06A 4hxyB-4apqD:
undetectable		 4hxyB-4apqD:
17.61
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.
4be3 ALGINATE LYASE,
FAMILY PL7

(Zobellia
galactanivorans) 		PF08787
(Alginate_lyase2) 		4 SER A  99
GLN A 301
TYR A 299
ASP A 191
 None
 1.06A 4hxyB-4be3A:
undetectable		 4hxyB-4be3A:
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.
4by9 FIBRILLARIN-LIKE
RRNA/TRNA
2'-O-METHYLTRANSFERA
SE

(Pyrococcus
furiosus) 		PF01269
(Fibrillarin) 		4 VAL E  35
SER E  92
GLN E  33
LEU E 114
 None
 1.13A 4hxyB-4by9E:
5.4		 4hxyB-4by9E:
18.75
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.
4cql ESTRADIOL
17-BETA-DEHYDROGENAS
E 8

(Homo sapiens) 		PF13561
(adh_short_C2) 		4 SER A 156
GLN A 166
TYR A 169
MET A 206
 NAD  A 301 (-3.1A)
None
None
NAD  A 301 (-3.7A)
 0.63A 4hxyB-4cqlA:
19.4		 4hxyB-4cqlA:
24.27
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.
4d4g APNAA1

(Planktothrix
agardhii) 		PF00501
(AMP-binding)
PF13193
(AMP-binding_C) 		4 VAL A  61
SER A 196
MET A  67
LEU A  71
 None
 1.24A 4hxyB-4d4gA:
undetectable		 4hxyB-4d4gA:
22.33
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4eoc PHYCOCYANOBILIN:FERR
EDOXIN
OXIDOREDUCTASE

(Synechocystis
sp. PCC 6803) 		PF05996
(Fe_bilin_red) 		4 SER A 121
GLN A 216
TYR A 212
ASP A 105
 None
BLA  A1001 (-3.5A)
None
BLA  A1001 (-2.8A)
 1.24A 4hxyB-4eocA:
undetectable		 4hxyB-4eocA:
20.63
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.
4hnl MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME

(Enterococcus
gallinarum) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		4 VAL A 319
SER A 313
MET A  95
ASP A  99
 None
 1.24A 4hxyB-4hnlA:
undetectable		 4hxyB-4hnlA:
23.16
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.
4iin 3-KETOACYL-ACYL
CARRIER PROTEIN
REDUCTASE (FABG)

(Helicobacter
pylori) 		PF13561
(adh_short_C2) 		4 VAL A  94
SER A 142
GLN A 152
TYR A 155
 None
NAD  A 301 (-3.4A)
None
NAD  A 301 (-4.7A)
 0.53A 4hxyB-4iinA:
20.3		 4hxyB-4iinA:
18.36
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.
4iiv 3-OXOACYL-[ACYL-CARR
IER PROTEIN]
REDUCTASE

(Escherichia
coli) 		PF13561
(adh_short_C2) 		4 SER A 140
GLN A 150
TYR A 153
MET A 190
 NAP  A1901 ( 3.7A)
None
NAP  A1901 (-4.6A)
NAP  A1901 (-3.7A)
 0.52A 4hxyB-4iivA:
20.2		 4hxyB-4iivA:
22.65
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4imp POLYKETIDE SYNTHASE
EXTENDER MODULES 3-4

(Saccharopolyspora
spinosa) 		PF08659
(KR) 		4 SER A 412
GLN A 422
TYR A 425
MET A 459
 NDP  A1501 ( 4.5A)
None
NDP  A1501 (-4.8A)
NDP  A1501 (-3.4A)
 0.55A 4hxyB-4impA:
46.7		 4hxyB-4impA:
37.48
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.
4itu SHORT-CHAIN
DEHYDROGENASE/REDUCT
ASE SDR

(Xanthobacter
autotrophicus) 		PF13561
(adh_short_C2) 		4 SER A 143
TYR A 156
MET A 194
LEU A 198
 1HS  A 302 ( 2.5A)
1HS  A 302 ( 4.3A)
NAI  A 301 (-3.6A)
None
 1.10A 4hxyB-4ituA:
19.6		 4hxyB-4ituA:
23.30
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4j1s POLYKETIDE SYNTHASE
PKSJ

(Bacillus
subtilis) 		PF08659
(KR) 		4 SER A 317
GLN A 327
TYR A 330
MET A 370
 None
 0.62A 4hxyB-4j1sA:
36.6		 4hxyB-4j1sA:
27.08
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.
4jhr G-PROTEIN-SIGNALING
MODULATOR 2

(Mus musculus) 		PF02188
(GoLoco)
PF13176
(TPR_7)
PF13424
(TPR_12) 		4 VAL A 619
SER A 320
TYR A 279
ASP A 589
 None
 1.05A 4hxyB-4jhrA:
undetectable		 4hxyB-4jhrA:
23.16
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.
4jy6 PGT123 HEAVY CHAIN
PGT123 LIGHT CHAIN

(Homo sapiens) 		PF07654
(C1-set)
PF07686
(V-set) 		4 VAL B 167
SER A 183
GLN B 169
LEU B 139
 None
 1.19A 4hxyB-4jy6B:
undetectable		 4hxyB-4jy6B:
19.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ktd GE136 HEAVY CHAIN
FAB
GE136 LIGHT CHAIN
FAB

(Macaca mulatta) 		PF07654
(C1-set)
PF07686
(V-set) 		4 VAL H 169
SER L 179
GLN H 171
LEU H 141
 None
 1.23A 4hxyB-4ktdH:
undetectable		 4hxyB-4ktdH:
19.06
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.
4m0m PUTATIVE
UNCHARACTERIZED
PROTEIN

(Legionella
pneumophila) 		no annotation 4 SER A 197
TYR A 216
MET A 151
ASP A 148
 None
 0.86A 4hxyB-4m0mA:
undetectable		 4hxyB-4m0mA:
17.46
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.
4m8n PLEXINC1
INTRACELLULAR REGION

(Danio rerio) 		PF08337
(Plexin_cytopl) 		4 SER A 940
GLN A 751
TYR A 766
ASP A 588
 None
 1.13A 4hxyB-4m8nA:
undetectable		 4hxyB-4m8nA:
21.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4nbu 3-OXOACYL-(ACYL-CARR
IER-PROTEIN)
REDUCTASE

(Bacillus sp.
SG-1) 		PF13561
(adh_short_C2) 		4 SER A 145
GLN A 155
TYR A 158
MET A 195
 NAI  A 301 (-3.3A)
None
NAI  A 301 (-4.5A)
NAI  A 301 (-3.6A)
 0.51A 4hxyB-4nbuA:
20.3		 4hxyB-4nbuA:
21.04
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.
4nnq PUTATIVE ENOYL-COA
HYDRATASE

(Streptomyces
atroolivaceus) 		PF00378
(ECH_1) 		4 VAL A 154
MET A  97
LEU A  94
ASP A 229
 None
 1.24A 4hxyB-4nnqA:
undetectable		 4hxyB-4nnqA:
25.50
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.
4o0l NADPH-DEPENDENT
3-QUINUCLIDINONE
REDUCTASE

(Rhodotorula
mucilaginosa) 		PF13561
(adh_short_C2) 		4 SER A 166
GLN A 178
TYR A 181
MET A 217
 NDP  A 300 (-3.5A)
None
NDP  A 300 (-4.8A)
NDP  A 300 (-3.7A)
 0.91A 4hxyB-4o0lA:
19.9		 4hxyB-4o0lA:
21.04
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.
4ogc HNH ENDONUCLEASE
DOMAIN PROTEIN

(Actinomyces
naeslundii) 		PF01844
(HNH) 		4 VAL A 810
SER A 741
LEU A 721
ASP A 732
 None
 1.08A 4hxyB-4ogcA:
undetectable		 4hxyB-4ogcA:
19.08
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.
4owt INTEGRATOR COMPLEX
SUBUNIT 3

(Homo sapiens) 		PF10189
(Ints3) 		4 SER A 155
TYR A 108
MET A 119
LEU A 123
 None
 1.20A 4hxyB-4owtA:
undetectable		 4hxyB-4owtA:
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.
4piv FATTY ACID SYNTHASE

(Homo sapiens) 		PF08242
(Methyltransf_12)
PF08659
(KR) 		4 SER A2021
GLN A2031
TYR A2034
LEU A2069
 2W4  A2205 (-2.7A)
2W4  A2205 ( 4.1A)
2W4  A2205 ( 4.4A)
NDP  A2202 ( 3.5A)
 0.83A 4hxyB-4pivA:
36.1		 4hxyB-4pivA:
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.
4rgb CARVEOL
DEHYDROGENASE

(Mycobacterium
avium) 		PF13561
(adh_short_C2) 		4 VAL A 120
SER A 169
TYR A 186
MET A 223
 None
NAD  A 301 (-3.4A)
NAD  A 301 (-4.6A)
NAD  A 301 (-3.5A)
 0.71A 4hxyB-4rgbA:
18.3		 4hxyB-4rgbA:
24.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4rsm PERIPLASMIC BINDING
PROTEIN/LACI
TRANSCRIPTIONAL
REGULATOR

(Mycolicibacterium
smegmatis) 		PF13407
(Peripla_BP_4) 		4 VAL A  96
SER A  45
TYR A  42
LEU A 275
 None
3VB  A 401 ( 4.7A)
3VB  A 401 (-4.5A)
None
 1.21A 4hxyB-4rsmA:
undetectable		 4hxyB-4rsmA:
23.70
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.
4wh3 N-ACETYLHEXOSAMINE
1-KINASE

(Bifidobacterium
longum) 		PF01636
(APH) 		4 GLN A  48
TYR A 102
MET A  62
LEU A  61
 ATP  A 401 (-3.4A)
None
None
None
 1.22A 4hxyB-4wh3A:
undetectable		 4hxyB-4wh3A:
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.
4xgn 3-HYDROXYACYL-COA
DEHYDROGENASE

(Burkholderia
thailandensis) 		PF00106
(adh_short) 		4 SER A 145
GLN A 155
TYR A 158
MET A 195
 NAD  A 300 ( 3.8A)
None
EDO  A 301 ( 4.2A)
NAD  A 300 (-3.8A)
 0.65A 4hxyB-4xgnA:
3.0		 4hxyB-4xgnA:
23.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4yqy PUTATIVE
DEHYDROGENASE

(Sulfitobacter
sp. NAS-14.1) 		PF13561
(adh_short_C2) 		4 VAL A 224
SER A 135
LEU A   3
ASP A   2
 None
 1.25A 4hxyB-4yqyA:
19.7		 4hxyB-4yqyA:
21.63
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ztc AMINOTRANSFERASE
HOMOLOG

(Campylobacter
jejuni) 		PF01041
(DegT_DnrJ_EryC1) 		4 VAL A 373
SER A 283
TYR A 259
MET A 368
 None
 1.05A 4hxyB-4ztcA:
undetectable		 4hxyB-4ztcA:
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.
5d2e MLNE

(Bacillus
velezensis) 		PF08659
(KR) 		4 VAL A 364
SER A 408
GLN A 418
TYR A 421
 None
NAP  A 601 ( 4.0A)
None
NAP  A 601 (-4.4A)
 0.55A 4hxyB-5d2eA:
35.0		 4hxyB-5d2eA:
25.05
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.
5e31 PENICILLIN BINDING
PROTEIN 2 PRIME

(Enterococcus
faecium) 		PF00905
(Transpeptidase)
PF03717
(PBP_dimer)
PF05223
(MecA_N) 		4 VAL A  96
TYR A  91
MET A 122
LEU A 129
 None
 1.15A 4hxyB-5e31A:
undetectable		 4hxyB-5e31A:
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.
5f89 CAP248-2B HEAVY
CHAIN
CAP248-2B LIGHT
CHAIN

(Homo sapiens) 		no annotation 4 VAL H 169
SER L 180
GLN H 171
LEU H 141
 None
 1.08A 4hxyB-5f89H:
undetectable		 4hxyB-5f89H:
17.93
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.
5fuk MROUPO

(Marasmius
rotula) 		PF01328
(Peroxidase_2) 		4 VAL A 180
SER A 114
TYR A 121
LEU A  90
 None
None
None
HEM  A1235 (-3.7A)
 0.97A 4hxyB-5fukA:
undetectable		 4hxyB-5fukA:
21.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5hzr SNF2-FAMILY ATP
DEPENDENT CHROMATIN
REMODELING FACTOR
LIKE PROTEIN

(Thermothelomyces
thermophila) 		PF00176
(SNF2_N)
PF00271
(Helicase_C)
PF14619
(SnAC) 		4 SER A 591
GLN A 558
LEU A 577
ASP A 579
 None
 1.22A 4hxyB-5hzrA:
undetectable		 4hxyB-5hzrA:
20.71
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.
5i01 PHOSPHOHEPTOSE
ISOMERASE

(Neisseria
gonorrhoeae) 		PF13580
(SIS_2) 		4 VAL A 132
MET A 156
LEU A 157
ASP A 161
 None
 1.11A 4hxyB-5i01A:
undetectable		 4hxyB-5i01A:
19.53
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.
5ikk HISTONE DEACETYLASE
CLR3

(Schizosaccharomyces
pombe) 		PF00850
(Hist_deacetyl)
PF09757
(Arb2) 		4 VAL A 585
SER A 628
TYR A 624
LEU A 609
 None
 1.26A 4hxyB-5ikkA:
undetectable		 4hxyB-5ikkA:
21.03
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.
5ktk POLYKETIDE SYNTHASE
PKSJ

(Bacillus
subtilis) 		PF08659
(KR) 		4 SER A 371
GLN A 383
TYR A 386
MET A 419
 NDP  A 601 ( 4.0A)
None
NDP  A 601 (-4.4A)
NDP  A 601 (-3.7A)
 0.58A 4hxyB-5ktkA:
36.7		 4hxyB-5ktkA:
28.68
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.
5osn CAPSID PROTEIN

(Enterovirus E) 		PF00073
(Rhv) 		4 VAL C 166
SER A  42
GLN C 222
MET A  49
 None
K  C 301 (-4.8A)
K  C 301 (-3.6A)
None
 1.08A 4hxyB-5osnC:
undetectable		 4hxyB-5osnC:
21.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5sy5 NEURONAL PAS
DOMAIN-CONTAINING
PROTEIN 1

(Mus musculus) 		PF00010
(HLH)
PF00989
(PAS)
PF08447
(PAS_3) 		4 VAL B 343
SER B 383
TYR B 369
LEU B 314
 None
 0.95A 4hxyB-5sy5B:
undetectable		 4hxyB-5sy5B:
21.13
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.
5syd AZURIN, CHIMERIC
CONSTRUCT

(Pseudomonas
aeruginosa) 		PF00127
(Copper-bind) 		4 SER A  78
GLN A  17
MET A  24
ASP A  22
 None
 1.21A 4hxyB-5sydA:
undetectable		 4hxyB-5sydA:
14.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5uj6 GLYCOSYL HYDROLASES
FAMILY 2, SUGAR
BINDING DOMAIN
PROTEIN

(Bacteroides
uniformis) 		PF00703
(Glyco_hydro_2)
PF02836
(Glyco_hydro_2_C)
PF02837
(Glyco_hydro_2_N)
PF11721
(Malectin)
PF16355
(DUF4982) 		4 VAL A 633
SER A 750
GLN A 744
LEU A 721
 None
 1.20A 4hxyB-5uj6A:
undetectable		 4hxyB-5uj6A:
19.16
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.
5x5y UNCHARACTERIZED
PROTEIN

(Pseudomonas
aeruginosa) 		PF03739
(YjgP_YjgQ) 		4 GLN F  37
TYR F  34
LEU F 132
ASP F 136
 None
 0.81A 4hxyB-5x5yF:
undetectable		 4hxyB-5x5yF:
22.08
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.
6b3r PIEZO-TYPE
MECHANOSENSITIVE ION
CHANNEL COMPONENT 1

(Mus musculus) 		no annotation 4 GLN A1356
TYR A1359
LEU A2506
ASP A2509
 None
 1.21A 4hxyB-6b3rA:
undetectable		 4hxyB-6b3rA:
11.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6cri -

(-) 		no annotation 4 VAL G 473
SER G 515
GLN G 470
ASP G 466
 None
 1.09A 4hxyB-6criG:
undetectable		 4hxyB-6criG:
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.
6cv0 SPIKE GLYCOPROTEIN

(Avian
coronavirus) 		no annotation 4 VAL A  49
SER A  23
LEU A 220
ASP A 222
 None
 1.16A 4hxyB-6cv0A:
undetectable		 4hxyB-6cv0A:
9.56
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.
6ftx -

(-) 		no annotation 4 VAL W 335
SER W 293
GLN W 339
ASP W1200
 None
 0.91A 4hxyB-6ftxW:
undetectable		 4hxyB-6ftxW:
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.
6gh8 -

(-) 		no annotation 4 VAL D 153
GLN D 188
TYR D 151
LEU D 102
 None
 0.98A 4hxyB-6gh8D:
undetectable		 4hxyB-6gh8D:
undetectable