SIMILAR PATTERNS OF AMINO ACIDS FOR 3V4T_H_ACTH503

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.
1cii COLICIN IA

(Escherichia
coli) 		PF01024
(Colicin)
PF11504
(Colicin_Ia) 		4 ARG A 513
ALA A 514
ILE A 516
GLY A 556
 None
 0.89A 3v4tH-1ciiA:
undetectable		 3v4tH-1ciiA:
22.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ded CYCLODEXTRIN
GLUCANOTRANSFERASE

(Bacillus sp.
1011) 		PF00128
(Alpha-amylase)
PF00686
(CBM_20)
PF01833
(TIG)
PF02806
(Alpha-amylase_C) 		4 ARG A 103
ALA A 102
ILE A  83
GLY A 155
 None
 1.00A 3v4tH-1dedA:
undetectable		 3v4tH-1dedA:
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.
1e3h GUANOSINE
PENTAPHOSPHATE
SYNTHETASE

(Streptomyces
antibioticus) 		PF00013
(KH_1)
PF01138
(RNase_PH)
PF03726
(PNPase) 		4 ALA A 489
ILE A 488
ARG A 349
GLY A 465
 None
 0.86A 3v4tH-1e3hA:
undetectable		 3v4tH-1e3hA:
22.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ecg GLUTAMINE
PHOSPHORIBOSYLPYROPH
OSPHATE
AMIDOTRANSFERASE

(Escherichia
coli) 		PF00156
(Pribosyltran)
PF13522
(GATase_6) 		4 ARG A 314
ALA A 313
ILE A 315
GLY A 279
 None
 1.01A 3v4tH-1ecgA:
undetectable		 3v4tH-1ecgA:
22.59
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.
1fhu O-SUCCINYLBENZOATE
SYNTHASE

(Escherichia
coli) 		PF13378
(MR_MLE_C) 		4 ARG A 276
ALA A 275
ILE A 277
GLY A 270
 None
 0.99A 3v4tH-1fhuA:
undetectable		 3v4tH-1fhuA:
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.
1im4 DBH

(Sulfolobus
solfataricus) 		PF00817
(IMS)
PF11798
(IMS_HHH) 		4 ARG A 127
ALA A 126
ILE A 123
GLY A 165
 None
 0.97A 3v4tH-1im4A:
undetectable		 3v4tH-1im4A:
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.
1lvl DIHYDROLIPOAMIDE
DEHYDROGENASE

(Pseudomonas
putida) 		PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2) 		4 ARG A 315
ALA A 316
ILE A 303
GLY A 143
 None
FAD  A 459 ( 3.7A)
None
FAD  A 459 (-3.3A)
 0.99A 3v4tH-1lvlA:
undetectable		 3v4tH-1lvlA:
24.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1miv TRNA CCA-ADDING
ENZYME

(Geobacillus
stearothermophilus) 		PF01743
(PolyA_pol)
PF12627
(PolyA_pol_RNAbd)
PF13735
(tRNA_NucTran2_2) 		4 ALA A 119
ILE A 118
ARG A 111
GLY A  27
 None
 0.93A 3v4tH-1mivA:
undetectable		 3v4tH-1mivA:
24.13
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.
1n7u ADSORPTION PROTEIN
P2

(Salmonella
virus PRD1) 		PF09214
(Prd1-P2) 		4 ALA A 227
ILE A 311
ARG A 151
GLY A 230
 None
None
None
ACT  A 560 (-4.0A)
 0.95A 3v4tH-1n7uA:
undetectable		 3v4tH-1n7uA:
21.19
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.
1s16 TOPOISOMERASE IV
SUBUNIT B

(Escherichia
coli) 		PF00204
(DNA_gyraseB)
PF02518
(HATPase_c) 		4 ALA A1309
ILE A1312
ARG A1292
GLY A1286
 None
 0.98A 3v4tH-1s16A:
undetectable		 3v4tH-1s16A:
24.03
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.
1v4g GLUTAMATE--CYSTEINE
LIGASE

(Escherichia
coli) 		PF04262
(Glu_cys_ligase) 		4 ARG A 450
ALA A 449
ILE A 451
GLY A 199
 None
 0.83A 3v4tH-1v4gA:
undetectable		 3v4tH-1v4gA:
22.73
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.
1wza ALPHA-AMYLASE A

(Halothermothrix
orenii) 		PF00128
(Alpha-amylase) 		4 ALA A  72
ILE A  71
HIS A 426
GLY A  75
 None
 0.94A 3v4tH-1wzaA:
undetectable		 3v4tH-1wzaA:
23.99
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.
1y9u PUTATIVE IRON
BINDING PROTEIN

(Bordetella
pertussis) 		PF13343
(SBP_bac_6) 		4 ALA A 183
ILE A 186
ARG A 173
GLY A 194
 None
 0.94A 3v4tH-1y9uA:
undetectable		 3v4tH-1y9uA:
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.
2b3x IRON-RESPONSIVE
ELEMENT BINDING
PROTEIN 1

(Homo sapiens) 		PF00330
(Aconitase)
PF00694
(Aconitase_C) 		4 ALA A 687
ILE A 686
ARG A 694
GLY A 722
 None
 0.85A 3v4tH-2b3xA:
undetectable		 3v4tH-2b3xA:
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.
2gen PROBABLE
TRANSCRIPTIONAL
REGULATOR

(Pseudomonas
aeruginosa) 		PF00440
(TetR_N) 		4 ALA A  59
ILE A  61
ARG A 118
HIS A 126
 None
 0.96A 3v4tH-2genA:
undetectable		 3v4tH-2genA:
20.56
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.
2h98 HTH-TYPE
TRANSCRIPTIONAL
REGULATOR CATM

(Acinetobacter
sp. ADP1) 		PF03466
(LysR_substrate) 		4 ALA A 134
ILE A 132
ARG A 274
GLY A 143
 None
 0.97A 3v4tH-2h98A:
undetectable		 3v4tH-2h98A:
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.
2inc TOLUENE, O-XYLENE
MONOOXYGENASE
OXYGENASE SUBUNIT

(Pseudomonas
stutzeri) 		PF02332
(Phenol_Hydrox) 		4 ALA B 146
ILE B 145
TRP B 215
GLY B 216
 None
 0.66A 3v4tH-2incB:
undetectable		 3v4tH-2incB:
23.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2okj GLUTAMATE
DECARBOXYLASE 1

(Homo sapiens) 		PF00282
(Pyridoxal_deC) 		4 ALA A 415
ILE A 416
ARG A 457
GLY A 246
 None
 0.97A 3v4tH-2okjA:
undetectable		 3v4tH-2okjA:
22.89
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.
2otd GLYCEROPHOSPHODIESTE
R PHOSPHODIESTERASE

(Shigella
flexneri) 		PF03009
(GDPD) 		4 ALA A 236
ILE A 237
HIS A  35
GLY A 241
 None
 0.82A 3v4tH-2otdA:
undetectable		 3v4tH-2otdA:
21.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2pb9 PHOSPHOMETHYLPYRIMID
INE KINASE

(Pyrococcus
furiosus) 		PF10120
(ThiP_synth) 		4 ALA A 401
ILE A 403
ARG A 351
GLY A 406
 None
 0.99A 3v4tH-2pb9A:
undetectable		 3v4tH-2pb9A:
20.99
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.
2v40 ADENYLOSUCCINATE
SYNTHETASE ISOZYME 2

(Homo sapiens) 		PF00709
(Adenylsucc_synt) 		4 ALA A 357
ILE A 438
HIS A 350
GLY A 354
 None
 0.98A 3v4tH-2v40A:
undetectable		 3v4tH-2v40A:
23.82
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.
2wjv REGULATOR OF
NONSENSE TRANSCRIPTS
1

(Homo sapiens) 		PF04851
(ResIII)
PF09416
(UPF1_Zn_bind)
PF13086
(AAA_11)
PF13087
(AAA_12) 		4 ALA A 824
ILE A 793
ARG A 832
GLY A 791
 None
None
SO4  A 993 (-3.4A)
None
 0.87A 3v4tH-2wjvA:
undetectable		 3v4tH-2wjvA:
20.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2x66 PRNB

(Pseudomonas
fluorescens) 		PF08933
(DUF1864) 		5 ARG A 353
ALA A 350
ILE A 275
TRP A 237
GLY A 238
 None
 0.98A 3v4tH-2x66A:
undetectable		 3v4tH-2x66A:
24.44
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.
2y0h PROBABLE PORIN

(Pseudomonas
aeruginosa) 		PF03573
(OprD) 		4 ALA A 238
ILE A 239
ARG A 169
HIS A 173
 None
 1.01A 3v4tH-2y0hA:
undetectable		 3v4tH-2y0hA:
22.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ynm LIGHT-INDEPENDENT
PROTOCHLOROPHYLLIDE
REDUCTASE
IRON-SULFUR
ATP-BINDING PROTEIN

(Prochlorococcus
marinus) 		PF00142
(Fer4_NifH) 		4 ARG A 187
ALA A 184
ILE A 188
GLY A 154
 None
None
None
AF3  A1299 (-3.5A)
 0.85A 3v4tH-2ynmA:
undetectable		 3v4tH-2ynmA:
23.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2zau SELENIDE, WATER
DIKINASE

(Aquifex
aeolicus) 		PF00586
(AIRS)
PF02769
(AIRS_C) 		4 ALA A 329
ILE A 238
ARG A 241
GLY A 163
 None
 0.85A 3v4tH-2zauA:
undetectable		 3v4tH-2zauA:
23.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3aeq LIGHT-INDEPENDENT
PROTOCHLOROPHYLLIDE
REDUCTASE SUBUNIT B

(Rhodobacter
capsulatus) 		PF00148
(Oxidored_nitro) 		4 ALA B 347
ILE B 345
ARG B 282
GLY B 309
 None
 0.95A 3v4tH-3aeqB:
undetectable		 3v4tH-3aeqB:
23.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3anv D-SERINE DEHYDRATASE

(Gallus gallus) 		PF01168
(Ala_racemase_N)
PF14031
(D-ser_dehydrat) 		4 ALA A  26
ILE A 244
HIS A  47
GLY A  53
 None
 0.97A 3v4tH-3anvA:
undetectable		 3v4tH-3anvA:
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.
3bv6 METAL-DEPENDENT
HYDROLASE

(Vibrio cholerae) 		PF13483
(Lactamase_B_3) 		4 ALA A 115
ILE A  60
HIS A 224
GLY A 226
 None
 0.86A 3v4tH-3bv6A:
undetectable		 3v4tH-3bv6A:
21.16
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.
3d0k PUTATIVE
POLY(3-HYDROXYBUTYRA
TE) DEPOLYMERASE
LPQC

(Bordetella
parapertussis) 		no annotation 4 ALA A 215
ILE A 214
ARG A 234
GLY A 267
 None
None
SO4  A 304 (-3.4A)
None
 0.85A 3v4tH-3d0kA:
undetectable		 3v4tH-3d0kA:
21.60
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.
3egj N-ACETYLGLUCOSAMINE-
6-PHOSPHATE
DEACETYLASE

(Vibrio cholerae) 		PF01979
(Amidohydro_1) 		4 ALA A 324
ILE A 323
ARG A 330
HIS A 258
 None
 0.75A 3v4tH-3egjA:
undetectable		 3v4tH-3egjA:
24.43
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.
3fah ALDEHYDE
OXIDOREDUCTASE

(Desulfovibrio
gigas) 		PF00111
(Fer2)
PF01315
(Ald_Xan_dh_C)
PF01799
(Fer2_2)
PF02738
(Ald_Xan_dh_C2) 		4 ALA A 877
ILE A 879
ARG A 890
GLY A 616
 None
 0.94A 3v4tH-3fahA:
undetectable		 3v4tH-3fahA:
21.07
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.
3fgt PUTATIVE
PHOSPHOLIPASE B-LIKE
2 28 KDA FORM
PUTATIVE
PHOSPHOLIPASE B-LIKE
2 40 KDA FORM

(Mus musculus;
Mus musculus) 		PF04916
(Phospholip_B)
PF04916
(Phospholip_B) 		5 ALA B 553
ILE B 589
TRP A 103
ARG B 485
GLY A 102
 None
 1.38A 3v4tH-3fgtB:
undetectable		 3v4tH-3fgtB:
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.
3fw8 RETICULINE OXIDASE

(Eschscholzia
californica) 		PF01565
(FAD_binding_4)
PF08031
(BBE) 		4 ALA A 219
ILE A 220
TRP A 228
GLY A 224
 None
 0.99A 3v4tH-3fw8A:
undetectable		 3v4tH-3fw8A:
21.23
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.
3gd5 ORNITHINE
CARBAMOYLTRANSFERASE

(Gloeobacter
violaceus) 		PF00185
(OTCace)
PF02729
(OTCace_N) 		4 ARG A 217
ALA A 187
ILE A 215
GLY A 166
 None
 0.91A 3v4tH-3gd5A:
undetectable		 3v4tH-3gd5A:
24.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3glb HTH-TYPE
TRANSCRIPTIONAL
REGULATOR CATM

(Acinetobacter
sp. ADP1) 		PF03466
(LysR_substrate) 		4 ALA A 134
ILE A 132
ARG A 274
GLY A 143
 None
 0.99A 3v4tH-3glbA:
undetectable		 3v4tH-3glbA:
20.33
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3gwf CYCLOHEXANONE
MONOOXYGENASE

(Rhodococcus sp.
HI-31) 		PF00743
(FMO-like) 		4 ALA A 148
ILE A 149
HIS A 166
GLY A 381
 None
None
None
NAP  A 542 (-3.2A)
 0.98A 3v4tH-3gwfA:
undetectable		 3v4tH-3gwfA:
22.78
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.
3ic1 SUCCINYL-DIAMINOPIME
LATE DESUCCINYLASE

(Haemophilus
influenzae) 		PF01546
(Peptidase_M20)
PF07687
(M20_dimer) 		4 ALA A 127
ILE A 126
HIS A 122
GLY A  56
 None
 0.84A 3v4tH-3ic1A:
undetectable		 3v4tH-3ic1A:
24.38
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.
3ius UNCHARACTERIZED
CONSERVED PROTEIN

(Ruegeria
pomeroyi) 		no annotation 5 ALA A  40
ILE A  41
ARG A  19
HIS A  10
GLY A  11
 None
None
None
None
FMT  A 285 ( 4.0A)
 1.45A 3v4tH-3iusA:
undetectable		 3v4tH-3iusA:
22.20
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.
3kkj AMINE OXIDASE,
FLAVIN-CONTAINING

(Pseudomonas
syringae group
genomosp. 3) 		PF01593
(Amino_oxidase)
PF13450
(NAD_binding_8) 		4 ALA A  13
ILE A  12
ARG A  40
GLY A 311
 FAD  A 401 (-3.1A)
None
FAD  A 401 (-3.6A)
None
 0.99A 3v4tH-3kkjA:
undetectable		 3v4tH-3kkjA:
22.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ose SERINE/THREONINE-PRO
TEIN KINASE MARK1

(Homo sapiens) 		PF02149
(KA1) 		4 ALA A 781
ILE A 785
HIS A 744
GLY A 745
 None
 0.97A 3v4tH-3oseA:
undetectable		 3v4tH-3oseA:
13.45
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.
3ps0 CRISPR-ASSOCIATED
PROTEIN, CSA2

(Sulfolobus
solfataricus) 		PF01905
(DevR) 		4 ALA A 118
ILE A 117
ARG A 218
GLY A  73
 None
 0.96A 3v4tH-3ps0A:
undetectable		 3v4tH-3ps0A:
25.52
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3r38 UDP-N-ACETYLGLUCOSAM
INE
1-CARBOXYVINYLTRANSF
ERASE 1

(Listeria
monocytogenes) 		PF00275
(EPSP_synthase) 		4 ALA A  94
ILE A  96
HIS A 127
GLY A 165
 None
None
None
SO4  A 433 (-3.7A)
 0.51A 3v4tH-3r38A:
55.6		 3v4tH-3r38A:
47.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3sg1 UDP-N-ACETYLGLUCOSAM
INE
1-CARBOXYVINYLTRANSF
ERASE 1

(Bacillus
anthracis) 		PF00275
(EPSP_synthase) 		4 ARG A  93
ALA A  94
HIS A 127
GLY A 166
 None
 0.44A 3v4tH-3sg1A:
61.8		 3v4tH-3sg1A:
50.22
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.
3slu M23 PEPTIDASE DOMAIN
PROTEIN

(Neisseria
meningitidis) 		PF01551
(Peptidase_M23) 		4 ARG A 379
ALA A 378
HIS A 375
GLY A 297
 None
None
NI  A   1 (-3.2A)
None
 0.88A 3v4tH-3sluA:
undetectable		 3v4tH-3sluA:
24.29
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3swd UDP-N-ACETYLGLUCOSAM
INE
1-CARBOXYVINYLTRANSF
ERASE

(Escherichia
coli) 		PF00275
(EPSP_synthase) 		6 ALA A  92
ILE A  94
TRP A  95
ARG A 120
HIS A 125
GLY A 164
 EPZ  A 501 ( 4.0A)
None
None
EPZ  A 501 (-4.1A)
None
EPZ  A 501 (-3.2A)
 0.42A 3v4tH-3swdA:
68.9		 3v4tH-3swdA:
93.30
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3swd UDP-N-ACETYLGLUCOSAM
INE
1-CARBOXYVINYLTRANSF
ERASE

(Escherichia
coli) 		PF00275
(EPSP_synthase) 		5 ARG A  91
ALA A  92
ILE A  94
ARG A 120
HIS A 125
 QPA  A 115 ( 4.1A)
EPZ  A 501 ( 4.0A)
None
EPZ  A 501 (-4.1A)
None
 0.76A 3v4tH-3swdA:
68.9		 3v4tH-3swdA:
93.30
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3swe UDP-N-ACETYLGLUCOSAM
INE
1-CARBOXYVINYLTRANSF
ERASE

(Haemophilus
influenzae) 		PF00275
(EPSP_synthase) 		6 ALA A  94
ILE A  96
TRP A  97
ARG A 122
HIS A 127
GLY A 166
 EPZ  A 508 (-3.5A)
None
None
EPZ  A 508 (-3.9A)
EPZ  A 508 (-4.7A)
EPZ  A 508 (-3.5A)
 0.33A 3v4tH-3sweA:
67.4		 3v4tH-3sweA:
74.23
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3swe UDP-N-ACETYLGLUCOSAM
INE
1-CARBOXYVINYLTRANSF
ERASE

(Haemophilus
influenzae) 		PF00275
(EPSP_synthase) 		5 ARG A  93
ALA A  94
ILE A  96
ARG A 122
HIS A 127
 QPA  A 117 ( 4.1A)
EPZ  A 508 (-3.5A)
None
EPZ  A 508 (-3.9A)
EPZ  A 508 (-4.7A)
 0.66A 3v4tH-3sweA:
67.4		 3v4tH-3sweA:
74.23
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3swg UDP-N-ACETYLGLUCOSAM
INE
1-CARBOXYVINYLTRANSF
ERASE

(Aquifex
aeolicus) 		PF00275
(EPSP_synthase) 		4 ARG A 100
ALA A 101
ARG A 129
HIS A 134
 QPA  A 124 ( 4.0A)
EPZ  A 518 (-3.6A)
EPZ  A 518 (-4.0A)
EPZ  A 518 ( 4.9A)
 0.69A 3v4tH-3swgA:
61.2		 3v4tH-3swgA:
44.80
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.
3tpa HEME-BINDING PROTEIN
A

(Glaesserella
parasuis) 		PF00496
(SBP_bac_5) 		4 ALA A 207
ILE A 193
HIS A  81
GLY A 190
 None
 0.78A 3v4tH-3tpaA:
2.4		 3v4tH-3tpaA:
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.
3ulb TARGET OF RAPAMYCIN
COMPLEX 2 SUBUNIT
AVO1

(Saccharomyces
cerevisiae) 		PF16979
(SIN1_PH) 		4 ALA A1088
ILE A1094
ARG A1163
GLY A1091
 None
 0.90A 3v4tH-3ulbA:
undetectable		 3v4tH-3ulbA:
14.74
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3vcy UDP-N-ACETYLGLUCOSAM
INE
1-CARBOXYVINYLTRANSF
ERASE

(Aliivibrio
fischeri) 		PF00275
(EPSP_synthase) 		7 ARG A  92
ALA A  93
ILE A  95
TRP A  96
ARG A 121
HIS A 126
GLY A 165
 GOL  A 503 (-3.9A)
GOL  A 503 (-3.6A)
GOL  A 503 (-4.9A)
GOL  A 503 (-4.2A)
PO4  A 502 (-3.0A)
GOL  A 503 ( 4.6A)
GOL  A 503 ( 2.9A)
 0.36A 3v4tH-3vcyA:
66.7		 3v4tH-3vcyA:
79.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3zjk BETA GLYCOSIDASE

(Thermus
thermophilus) 		PF00232
(Glyco_hydro_1) 		4 ALA A 273
ILE A 246
HIS A 199
GLY A 200
 None
 1.01A 3v4tH-3zjkA:
undetectable		 3v4tH-3zjkA:
24.58
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.
4bqq INTEGRASE

(Streptomyces
virus phiC31) 		PF00239
(Resolvase) 		4 ALA A 287
ILE A 329
HIS A 200
GLY A 327
 None
 0.83A 3v4tH-4bqqA:
undetectable		 3v4tH-4bqqA:
24.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4e8b RIBOSOMAL RNA SMALL
SUBUNIT
METHYLTRANSFERASE E

(Escherichia
coli) 		PF04452
(Methyltrans_RNA) 		4 ALA A 201
ILE A 204
ARG A 114
HIS A 172
 None
 0.95A 3v4tH-4e8bA:
undetectable		 3v4tH-4e8bA:
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.
4frx ANAEROBICALLY-INDUCE
D OUTER MEMBRANE
PORIN OPRE

(Pseudomonas
aeruginosa) 		PF03573
(OprD) 		4 ARG A 276
ALA A 277
ILE A 297
GLY A 332
 None
 0.80A 3v4tH-4frxA:
undetectable		 3v4tH-4frxA:
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.
4fuu LEUCINE
AMINOPEPTIDASE

(Bacteroides
thetaiotaomicron) 		PF04389
(Peptidase_M28) 		4 ARG A 118
ALA A 120
ILE A 173
GLY A 109
 None
 1.00A 3v4tH-4fuuA:
undetectable		 3v4tH-4fuuA:
22.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4gnr ABC TRANSPORTER
SUBSTRATE-BINDING
PROTEIN-BRANCHED
CHAIN AMINO ACID
TRANSPORT

(Streptococcus
pneumoniae) 		PF13458
(Peripla_BP_6) 		4 ARG A 250
ALA A 278
ILE A 281
GLY A 243
 None
 0.95A 3v4tH-4gnrA:
undetectable		 3v4tH-4gnrA:
23.44
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.
4h2k SUCCINYL-DIAMINOPIME
LATE DESUCCINYLASE

(Haemophilus
influenzae) 		PF01546
(Peptidase_M20) 		4 ALA A 127
ILE A 126
HIS A 122
GLY A  56
 None
 0.87A 3v4tH-4h2kA:
undetectable		 3v4tH-4h2kA:
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.
4iyo CYSTATHIONINE
GAMMA-LYASE-LIKE
PROTEIN, LYS201A
MODIFIED

(Xanthomonas
oryzae) 		PF01053
(Cys_Met_Meta_PP) 		4 ALA B 356
ILE B 358
ARG B 121
GLY B 114
 None
 0.86A 3v4tH-4iyoB:
undetectable		 3v4tH-4iyoB:
22.95
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.
4j5u SERINE
HYDROXYMETHYLTRANSFE
RASE

(Rickettsia
rickettsii) 		PF00464
(SHMT) 		4 ALA A 347
ILE A 348
ARG A 362
GLY A 329
 None
 1.01A 3v4tH-4j5uA:
undetectable		 3v4tH-4j5uA:
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.
4lgn CELLULOSE-BINDING,
FAMILY II

(Acidothermus
cellulolyticus) 		no annotation 4 ALA A 215
ARG A 131
HIS A 244
GLY A 263
 None
 0.91A 3v4tH-4lgnA:
undetectable		 3v4tH-4lgnA:
21.09
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.
4pyh PHOSPHOGLUCAN
PHOSPHATASE DSP4,
CHLOROPLASTIC

(Arabidopsis
thaliana) 		PF00782
(DSPc)
PF16561
(AMPK1_CBM) 		4 ARG A 173
ALA A 244
ILE A 246
GLY A 251
 None
 0.90A 3v4tH-4pyhA:
undetectable		 3v4tH-4pyhA:
23.82
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4r7u UDP-N-ACETYLGLUCOSAM
INE
1-CARBOXYVINYLTRANSF
ERASE

(Vibrio cholerae) 		PF00275
(EPSP_synthase) 		7 ARG A  92
ALA A  93
ILE A  95
TRP A  96
ARG A 121
HIS A 126
GLY A 165
 None
UD1  A 503 ( 4.8A)
None
None
UD1  A 503 (-3.8A)
UD1  A 503 ( 4.8A)
UD1  A 503 (-3.3A)
 0.24A 3v4tH-4r7uA:
67.1		 3v4tH-4r7uA:
80.43
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.
4rjz ABC TRANSPORTER,
SUBSTRATE BINDING
PROTEIN (SUGAR)

(Agrobacterium
fabrum) 		PF01547
(SBP_bac_1) 		4 ALA A  87
ILE A  88
HIS A  93
GLY A 136
 None
 0.92A 3v4tH-4rjzA:
undetectable		 3v4tH-4rjzA:
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.
4utg SUGAR KINASE

(Burkholderia
pseudomallei) 		PF00288
(GHMP_kinases_N)
PF08544
(GHMP_kinases_C) 		4 ALA A 234
ILE A 238
ARG A 240
GLY A 264
 None
 0.95A 3v4tH-4utgA:
undetectable		 3v4tH-4utgA:
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.
4y7d ALPHA/BETA HYDROLASE
FOLD PROTEIN

(Nakamurella
multipartita) 		PF00561
(Abhydrolase_1) 		4 ARG A  59
ALA A  60
ILE A  61
GLY A  99
 None
 0.89A 3v4tH-4y7dA:
undetectable		 3v4tH-4y7dA:
25.17
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4yji ARYL ACYLAMIDASE

(bacterium
CSBL00001) 		PF01425
(Amidase) 		4 ARG A 493
ALA A 491
TRP A  10
GLY A 174
 None
 0.87A 3v4tH-4yjiA:
undetectable		 3v4tH-4yjiA:
23.15
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4z8z UNCHARACTERIZED
PROTEIN

(Ruminiclostridium
thermocellum) 		no annotation 4 ALA A 265
ILE A 264
HIS A 197
GLY A 205
 None
 0.98A 3v4tH-4z8zA:
undetectable		 3v4tH-4z8zA:
22.58
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5bq2 UDP-N-ACETYLGLUCOSAM
INE
1-CARBOXYVINYLTRANSF
ERASE

(Pseudomonas
aeruginosa) 		PF00275
(EPSP_synthase) 		5 ARG A  93
ALA A  94
ILE A  96
ARG A 122
HIS A 127
 QPA  A 117 ( 4.3A)
EPU  A 501 ( 3.7A)
None
EPU  A 501 (-3.9A)
EPU  A 501 ( 4.8A)
 0.57A 3v4tH-5bq2A:
63.7		 3v4tH-5bq2A:
60.14
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.
5c70 GLUCURONIDASE

(Aspergillus
oryzae) 		PF00703
(Glyco_hydro_2)
PF02836
(Glyco_hydro_2_C)
PF02837
(Glyco_hydro_2_N) 		4 ALA A  88
ARG A 399
HIS A 105
GLY A 107
 None
 1.01A 3v4tH-5c70A:
undetectable		 3v4tH-5c70A:
22.76
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5cio PYRROLOQUINOLINE
QUINONE BIOSYNTHESIS
PROTEIN PQQF

(Serratia sp.
FS14) 		PF00675
(Peptidase_M16)
PF05193
(Peptidase_M16_C) 		4 ARG A 736
ALA A 737
ILE A 740
GLY A 578
 None
 0.97A 3v4tH-5cioA:
undetectable		 3v4tH-5cioA:
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.
5czz CRISPR-ASSOCIATED
ENDONUCLEASE CAS9

(Staphylococcus
aureus) 		PF13395
(HNH_4)
PF16592
(Cas9_REC) 		4 ARG A 209
TRP A 223
ARG A  59
GLY A 222
 U  B  64 ( 3.7A)
None
U  B  16 ( 2.4A)
None
 0.92A 3v4tH-5czzA:
undetectable		 3v4tH-5czzA:
17.83
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.
5ep8 PYRIMIDINE-NUCLEOSID
E PHOSPHORYLASE

(Bacillus
subtilis) 		PF00591
(Glycos_transf_3)
PF02885
(Glycos_trans_3N)
PF07831
(PYNP_C) 		4 ALA A 246
ILE A 247
ARG A 381
GLY A 377
 ALA  A 246 ( 0.0A)
ILE  A 247 ( 0.6A)
ARG  A 381 ( 0.6A)
GLY  A 377 ( 0.0A)
 0.96A 3v4tH-5ep8A:
undetectable		 3v4tH-5ep8A:
26.11
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.
5fkr ENDO-1,4-BETA-GLUCAN
ASE/XYLOGLUCANASE,
PUTATIVE, GLY74A

(Cellvibrio
japonicus) 		no annotation 4 ALA A 247
ARG A 163
HIS A 276
GLY A 295
 None
 0.89A 3v4tH-5fkrA:
undetectable		 3v4tH-5fkrA:
21.44
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.
5gmx CARBOXYLESTERASE

(uncultured
bacterium) 		PF00144
(Beta-lactamase) 		4 ALA A 238
ARG A 127
HIS A 161
GLY A 122
 None
 1.01A 3v4tH-5gmxA:
undetectable		 3v4tH-5gmxA:
22.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5hj5 GLUCOSAMINE-6-PHOSPH
ATE DEAMINASE

(Vibrio cholerae) 		PF01182
(Glucosamine_iso) 		4 ALA A 185
ILE A 159
HIS A 114
GLY A 109
 None
 0.99A 3v4tH-5hj5A:
undetectable		 3v4tH-5hj5A:
22.74
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5icq METHYLOCYSTIS PARVUS
OBBP MBNE

(Methylocystis
parvus) 		PF00496
(SBP_bac_5) 		4 ALA A 396
ILE A 398
ARG A 384
GLY A 401
 SO4  A 703 (-3.6A)
None
None
None
 0.99A 3v4tH-5icqA:
undetectable		 3v4tH-5icqA:
22.29
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.
5ifk PURINE NUCLEOSIDE
PHOSPHORYLASE

(Kluyveromyces
lactis) 		PF01048
(PNP_UDP_1) 		4 ALA A  11
ILE A  13
HIS A 110
GLY A  67
 None
 0.83A 3v4tH-5ifkA:
undetectable		 3v4tH-5ifkA:
21.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5lae PEROXISOMAL
N(1)-ACETYL-SPERMINE
/SPERMIDINE
OXIDASE,PEROXISOMAL
N(1)-ACETYL-SPERMINE
/SPERMIDINE OXIDASE

(Mus musculus) 		PF01593
(Amino_oxidase) 		4 ALA A  16
ILE A  15
ARG A  45
GLY A 477
 FAD  A1801 (-3.2A)
None
FAD  A1801 (-3.9A)
None
 0.99A 3v4tH-5laeA:
undetectable		 3v4tH-5laeA:
22.74
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5mog PHYTOENE
DEHYDROGENASE,
CHLOROPLASTIC/CHROMO
PLASTIC

(Oryza sativa) 		PF01593
(Amino_oxidase) 		4 ALA A 144
ILE A 143
HIS A 159
GLY A 157
 None
FAD  A 600 (-4.5A)
FAD  A 600 (-3.9A)
FAD  A 600 (-3.4A)
 0.77A 3v4tH-5mogA:
undetectable		 3v4tH-5mogA:
24.62
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5mso CARBOXYLIC ACID
REDUCTASE

(Mycobacterium
marinum) 		PF07993
(NAD_binding_4) 		4 ALA A1044
ILE A1045
ARG A 801
GLY A1049
 None
 0.86A 3v4tH-5msoA:
undetectable		 3v4tH-5msoA:
16.77
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.
5mu5 UNCHARACTERIZED
PROTEIN

(Magnetospirillum
magneticum) 		no annotation 4 ALA A 198
ILE A 199
HIS A 123
GLY A 146
 None
 0.97A 3v4tH-5mu5A:
undetectable		 3v4tH-5mu5A:
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.
5opz CHIX

(Serratia
marcescens) 		no annotation 4 ALA A  93
ILE A  95
TRP A 112
GLY A 122
 None
 0.99A 3v4tH-5opzA:
undetectable		 3v4tH-5opzA:
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.
5u2w SHORT CHAIN
DEHYDROGENASE

(Burkholderia
cenocepacia) 		PF00106
(adh_short) 		4 ALA A 161
ILE A 163
HIS A 184
GLY A 140
 None
 1.00A 3v4tH-5u2wA:
undetectable		 3v4tH-5u2wA:
23.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5u4h UDP-N-ACETYLGLUCOSAM
INE
1-CARBOXYVINYLTRANSF
ERASE

(Acinetobacter
baumannii) 		PF00275
(EPSP_synthase) 		4 ALA A  93
ILE A  95
HIS A 126
GLY A 165
 None
 0.44A 3v4tH-5u4hA:
64.3		 3v4tH-5u4hA:
58.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5v4q GAMMA-GLUTAMYLTRANSP
EPTIDASE 1 LIGHT
CHAIN

(Homo sapiens) 		PF01019
(G_glu_transpept) 		4 ALA B 472
ILE B 477
ARG B 503
GLY B 470
 CL  B1103 (-3.6A)
None
None
None
 0.91A 3v4tH-5v4qB:
undetectable		 3v4tH-5v4qB:
18.53
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.
5vkp POTASSIUM CHANNEL
SUBFAMILY K MEMBER 2

(Mus musculus) 		PF07885
(Ion_trans_2) 		4 ILE A 148
ARG A 151
HIS A 126
GLY A 113
 None
 0.84A 3v4tH-5vkpA:
undetectable		 3v4tH-5vkpA:
21.81
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5wi5 UDP-N-ACETYLGLUCOSAM
INE
1-CARBOXYVINYLTRANSF
ERASE 1

(Streptococcus
pneumoniae) 		PF00275
(EPSP_synthase) 		5 ALA A  97
ILE A  99
ARG A 125
HIS A 130
GLY A 168
 EPU  A 503 (-3.4A)
None
EPU  A 503 (-4.0A)
EPU  A 503 ( 4.9A)
EPU  A 503 (-3.3A)
 0.65A 3v4tH-5wi5A:
60.5		 3v4tH-5wi5A:
50.58
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5wi5 UDP-N-ACETYLGLUCOSAM
INE
1-CARBOXYVINYLTRANSF
ERASE 1

(Streptococcus
pneumoniae) 		PF00275
(EPSP_synthase) 		5 ARG A  96
ALA A  97
ILE A  99
ARG A 125
HIS A 130
 None
EPU  A 503 (-3.4A)
None
EPU  A 503 (-4.0A)
EPU  A 503 ( 4.9A)
 0.79A 3v4tH-5wi5A:
60.5		 3v4tH-5wi5A:
50.58
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.
5y3r DNA-DEPENDENT
PROTEIN KINASE
CATALYTIC SUBUNIT

(Homo sapiens) 		PF00454
(PI3_PI4_kinase)
PF02259
(FAT)
PF02260
(FATC)
PF08163
(NUC194) 		4 ALA C1012
ILE C1013
ARG C1075
GLY C1016
 None
 0.94A 3v4tH-5y3rC:
undetectable		 3v4tH-5y3rC:
7.39
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.
5zct -

(-) 		no annotation 4 ALA A  95
ILE A  94
ARG A  78
GLY A  73
 None
 0.94A 3v4tH-5zctA:
undetectable		 3v4tH-5zctA:
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.
5ze4 DIHYDROXY-ACID
DEHYDRATASE,
CHLOROPLASTIC

(Arabidopsis
thaliana) 		no annotation 4 ALA A 296
ILE A 297
ARG A 152
GLY A 145
 None
 0.89A 3v4tH-5ze4A:
undetectable		 3v4tH-5ze4A:
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.
6am5 -

(-) 		no annotation 4 ALA D  18
ILE D  17
ARG D  59
GLY D  15
 None
 0.97A 3v4tH-6am5D:
undetectable		 3v4tH-6am5D:
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.
6c9d SERINE/THREONINE-PRO
TEIN KINASE
MARK1,SERINE/THREONI
NE-PROTEIN KINASE
MARK1

(Homo sapiens) 		no annotation 4 ALA A 781
ILE A 785
HIS A 744
GLY A 745
 None
 0.94A 3v4tH-6c9dA:
undetectable		 3v4tH-6c9dA:
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.
6cmz DIHYDROLIPOYL
DEHYDROGENASE

(Burkholderia
cenocepacia) 		no annotation 4 ARG A 320
ALA A 321
ILE A 308
GLY A 147
 None
FAD  A 502 ( 4.0A)
None
FAD  A 502 (-3.0A)
 1.00A 3v4tH-6cmzA:
undetectable		 3v4tH-6cmzA:
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.
6cn1 UDP-N-ACETYLGLUCOSAM
INE
1-CARBOXYVINYLTRANSF
ERASE

(Pseudomonas
putida) 		no annotation 5 ARG A  93
ALA A  94
ILE A  96
ARG A 122
HIS A 127
 None
EPU  A 501 (-3.6A)
None
EPU  A 501 (-3.9A)
None
 0.60A 3v4tH-6cn1A:
63.8		 3v4tH-6cn1A:
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.
6cn1 UDP-N-ACETYLGLUCOSAM
INE
1-CARBOXYVINYLTRANSF
ERASE

(Pseudomonas
putida) 		no annotation 4 ILE A  96
ARG A 122
HIS A 127
GLY A 168
 None
EPU  A 501 (-3.9A)
None
None
 1.01A 3v4tH-6cn1A:
63.8		 3v4tH-6cn1A:
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.
6d3i -

(-) 		no annotation 4 ALA A 156
ILE A 158
ARG A 213
GLY A 160
 None
 0.98A 3v4tH-6d3iA:
undetectable		 3v4tH-6d3iA:
undetectable