SIMILAR PATTERNS OF AMINO ACIDS FOR 4XQG_A_AG2A505

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.
1a8q BROMOPEROXIDASE A1

(Kitasatospora
aureofaciens) 		PF00561
(Abhydrolase_1) 		4 ARG A   6
ASP A  75
PHE A  72
ASP A  68
 None
 1.17A 4xqgA-1a8qA:
3.4		 4xqgA-1a8qA:
22.53
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.
1ct9 ASPARAGINE
SYNTHETASE B

(Escherichia
coli) 		PF00733
(Asn_synthase)
PF13537
(GATase_7) 		4 ARG A 387
ASP A 384
VAL A 320
ASP A 319
 None
IUM  A1103 (-2.7A)
None
None
 1.04A 4xqgA-1ct9A:
2.4		 4xqgA-1ct9A:
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.
1euz GLUTAMATE
DEHYDROGENASE

(Thermococcus
profundus) 		PF00208
(ELFV_dehydrog)
PF02812
(ELFV_dehydrog_N) 		5 ARG A  16
ARG A 331
ASP A 397
ASP A 327
ASP A 328
 None
SO4  A 603 (-4.5A)
None
None
None
 1.19A 4xqgA-1euzA:
2.3		 4xqgA-1euzA:
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.
1foh PHENOL HYDROXYLASE

(Cutaneotrichosporon
cutaneum) 		PF01494
(FAD_binding_3)
PF07976
(Phe_hydrox_dim) 		4 ARG A  31
ARG A  24
VAL A  25
ASP A 507
 None
 1.04A 4xqgA-1fohA:
4.3		 4xqgA-1fohA:
21.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1kcv PC282 IMMUNOGLOBULIN

(Mus musculus) 		PF07654
(C1-set)
PF07686
(V-set) 		4 ARG H  67
VAL H  86
ASP H  89
ASP H  90
 None
 0.95A 4xqgA-1kcvH:
undetectable		 4xqgA-1kcvH:
18.03
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.
1ofe FERREDOXIN-DEPENDENT
GLUTAMATE SYNTHASE 2

(Synechocystis
sp. PCC 6803) 		PF00310
(GATase_2)
PF01493
(GXGXG)
PF01645
(Glu_synthase)
PF04898
(Glu_syn_central) 		4 ARG A  52
ARG A  71
ASP A  68
ASP A  70
 None
 1.11A 4xqgA-1ofeA:
undetectable		 4xqgA-1ofeA:
15.54
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.
1pgj 6-PHOSPHOGLUCONATE
DEHYDROGENASE

(Trypanosoma
brucei) 		PF00393
(6PGD)
PF03446
(NAD_binding_2) 		4 ARG A 298
ASP A 257
VAL A 423
ASP A 204
 None
 0.92A 4xqgA-1pgjA:
4.6		 4xqgA-1pgjA:
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.
1qyd PINORESINOL-LARICIRE
SINOL REDUCTASE

(Thuja plicata) 		PF05368
(NmrA) 		4 ARG A 311
VAL A 195
ASP A 198
ASP A 199
 None
 0.82A 4xqgA-1qydA:
9.5		 4xqgA-1qydA:
20.04
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.
1u2v ARP2/3 COMPLEX 34KDA
SUBUNIT

(Bos taurus) 		PF04045
(P34-Arc) 		4 ARG D 118
ARG D 237
ASP D 238
VAL D 124
 None
 0.80A 4xqgA-1u2vD:
undetectable		 4xqgA-1u2vD:
19.25
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.
1u3d CRYPTOCHROME 1
APOPROTEIN

(Arabidopsis
thaliana) 		PF00875
(DNA_photolyase)
PF03441
(FAD_binding_7) 		4 ARG A  20
ARG A 118
ASP A 112
ASP A 119
 None
 1.06A 4xqgA-1u3dA:
2.3		 4xqgA-1u3dA:
22.86
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.
1u3d CRYPTOCHROME 1
APOPROTEIN

(Arabidopsis
thaliana) 		PF00875
(DNA_photolyase)
PF03441
(FAD_binding_7) 		4 ARG A 118
ARG A  20
ASP A 119
ASP A 112
 None
 0.93A 4xqgA-1u3dA:
2.3		 4xqgA-1u3dA:
22.86
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.
1wqa PHOSPHO-SUGAR MUTASE

(Pyrococcus
horikoshii) 		PF00408
(PGM_PMM_IV)
PF02878
(PGM_PMM_I)
PF02879
(PGM_PMM_II)
PF02880
(PGM_PMM_III) 		4 ARG A  11
ARG A  51
ASP A 245
VAL A  10
 ARG  A  11 ( 0.6A)
ARG  A  51 ( 0.6A)
ASP  A 245 (-0.6A)
VAL  A  10 ( 0.6A)
 0.97A 4xqgA-1wqaA:
undetectable		 4xqgA-1wqaA:
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.
1xre SUPEROXIDE DISMUTASE

(Bacillus
anthracis) 		PF00081
(Sod_Fe_N)
PF02777
(Sod_Fe_C) 		4 ARG A  93
ARG A 194
VAL A 190
ASP A 193
 None
 1.09A 4xqgA-1xreA:
undetectable		 4xqgA-1xreA:
17.51
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.
2aaf ARGININE DEIMINASE

(Pseudomonas
aeruginosa) 		PF02274
(Amidinotransf) 		4 ARG A  31
VAL A 127
ASP A 130
ASP A 131
 None
 1.01A 4xqgA-2aafA:
undetectable		 4xqgA-2aafA:
24.56
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.
2b34 MAR1 RIBONUCLEASE

(Caenorhabditis
elegans) 		PF00857
(Isochorismatase) 		4 ARG A 144
ASP A 190
VAL A 136
ASP A 134
 None
 1.13A 4xqgA-2b34A:
5.4		 4xqgA-2b34A:
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.
2cun PHOSPHOGLYCERATE
KINASE

(Pyrococcus
horikoshii) 		PF00162
(PGK) 		4 ARG A 283
ASP A 303
PHE A 275
ASP A 274
 None
 0.81A 4xqgA-2cunA:
3.1		 4xqgA-2cunA:
23.22
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.
2hnh DNA POLYMERASE III
ALPHA SUBUNIT

(Escherichia
coli) 		PF02811
(PHP)
PF07733
(DNA_pol3_alpha)
PF14579
(HHH_6) 		4 ARG A 303
ARG A 362
ASP A 378
VAL A 370
 None
 1.08A 4xqgA-2hnhA:
undetectable		 4xqgA-2hnhA:
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.
2opj O-SUCCINYLBENZOATE-C
OA SYNTHASE

(Thermobifida
fusca) 		PF13378
(MR_MLE_C) 		4 ARG A 280
ASP A 268
VAL A 234
ASP A 283
 None
 1.06A 4xqgA-2opjA:
undetectable		 4xqgA-2opjA:
24.10
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.
2oyp HEPATITIS A VIRUS
CELLULAR RECEPTOR 2

(Mus musculus) 		PF07686
(V-set) 		4 ARG A  82
VAL A 101
ASP A 104
ASP A 105
 SO4  A 500 (-4.1A)
None
None
None
 1.12A 4xqgA-2oypA:
undetectable		 4xqgA-2oypA:
14.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2q17 FORMYLGLYCINE
GENERATING ENZYME

(Streptomyces
coelicolor) 		PF03781
(FGE-sulfatase) 		4 ARG A 285
ASP A  47
VAL A 282
ASP A  38
 None
 1.12A 4xqgA-2q17A:
undetectable		 4xqgA-2q17A:
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.
2qml BH2621 PROTEIN

(Bacillus
halodurans) 		PF13523
(Acetyltransf_8) 		4 ARG A  24
VAL A  26
ASP A  29
ASP A  30
 None
 1.09A 4xqgA-2qmlA:
undetectable		 4xqgA-2qmlA:
17.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2rkv TRICHOTHECENE
3-O-ACETYLTRANSFERAS
E

(Fusarium
graminearum) 		PF02458
(Transferase) 		4 ARG A 335
VAL A 259
ASP A 262
ASP A 263
 COA  A 452 (-2.9A)
None
COA  A 452 ( 3.6A)
COA  A 452 ( 4.3A)
 1.16A 4xqgA-2rkvA:
undetectable		 4xqgA-2rkvA:
21.54
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.
2wbp L-ARGININE
BETA-HYDROXYLASE

(Streptomyces
vinaceus) 		PF02668
(TauD) 		4 ARG A 289
ARG A 220
PHE A 271
ASP A 270
 None
None
ZZU  A1359 (-4.8A)
ZZU  A1359 (-3.9A)
 0.99A 4xqgA-2wbpA:
undetectable		 4xqgA-2wbpA:
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.
2wqd PHOSPHOENOLPYRUVATE-
PROTEIN
PHOSPHOTRANSFERASE

(Staphylococcus
aureus) 		PF00391
(PEP-utilizers)
PF02896
(PEP-utilizers_C)
PF05524
(PEP-utilisers_N) 		4 ARG A 360
ARG A 467
ASP A 457
ASP A 466
 None
 1.15A 4xqgA-2wqdA:
undetectable		 4xqgA-2wqdA:
23.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2x66 PRNB

(Pseudomonas
fluorescens) 		PF08933
(DUF1864) 		4 ARG A 283
ARG A 353
ASP A 280
VAL A 354
 None
 1.01A 4xqgA-2x66A:
undetectable		 4xqgA-2x66A:
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.
2xy1 NEURAL CELL ADHESION
MOLECULE 2

(Homo sapiens) 		PF07679
(I-set) 		4 ARG A 353
ARG A 336
VAL A 370
ASP A 374
 None
 1.17A 4xqgA-2xy1A:
undetectable		 4xqgA-2xy1A:
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.
2ze4 PHOSPHOLIPASE D

(Streptomyces
antibioticus) 		PF13091
(PLDc_2) 		4 ARG A 352
ASP A 303
ASP A 308
ASP A 312
 None
 1.10A 4xqgA-2ze4A:
undetectable		 4xqgA-2ze4A:
23.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2zii VACUOLAR PROTEIN
SORTING-ASSOCIATED
PROTEIN 74

(Saccharomyces
cerevisiae) 		PF05719
(GPP34) 		4 ARG A 340
ARG A 126
ASP A 122
VAL A 334
 None
 1.09A 4xqgA-2ziiA:
undetectable		 4xqgA-2ziiA:
20.30
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.
3ctp PERIPLASMIC BINDING
PROTEIN/LACI
TRANSCRIPTIONAL
REGULATOR

(Alkaliphilus
metalliredigens) 		PF13377
(Peripla_BP_3) 		4 ARG A 124
ARG A 190
ASP A 213
ASP A 267
 XLF  A 401 (-4.0A)
XLF  A 401 (-2.8A)
XLF  A 401 ( 4.3A)
XLF  A 401 (-2.8A)
 1.10A 4xqgA-3ctpA:
undetectable		 4xqgA-3ctpA:
20.88
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.
3f7p PLECTIN-1

(Homo sapiens) 		PF00307
(CH) 		4 ARG A  69
VAL A  70
ASP A 264
ASP A 267
 None
 0.85A 4xqgA-3f7pA:
undetectable		 4xqgA-3f7pA:
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.
3git CARBON MONOXIDE
DEHYDROGENASE/ACETYL
-COA SYNTHASE
SUBUNIT ALPHA

(Moorella
thermoacetica) 		PF03598
(CdhC) 		4 ARG A 488
ASP A 489
VAL A 531
ASP A 535
 None
None
SF4  A 738 (-4.2A)
None
 0.88A 4xqgA-3gitA:
undetectable		 4xqgA-3gitA:
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.
3h6z POLYCOMB PROTEIN
SFMBT

(Drosophila
melanogaster) 		PF02820
(MBT) 		4 ARG A 759
VAL A 770
ASP A 773
ASP A 774
 None
 0.94A 4xqgA-3h6zA:
undetectable		 4xqgA-3h6zA:
22.27
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.
3hz6 XYLULOKINASE

(Chromobacterium
violaceum) 		PF00370
(FGGY_N)
PF02782
(FGGY_C) 		4 ARG A 461
VAL A 251
ASP A 253
ASP A 256
 None
 0.95A 4xqgA-3hz6A:
undetectable		 4xqgA-3hz6A:
22.00
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.
3ivu HOMOCITRATE
SYNTHASE,
MITOCHONDRIAL

(Schizosaccharomyces
pombe) 		PF00682
(HMGL-like) 		4 ARG A 388
ARG A 397
ASP A 393
ASP A 394
 None
 1.04A 4xqgA-3ivuA:
undetectable		 4xqgA-3ivuA:
22.18
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.
3jbz SERINE/THREONINE-PRO
TEIN KINASE MTOR

(Homo sapiens) 		PF00454
(PI3_PI4_kinase)
PF02259
(FAT)
PF02260
(FATC)
PF08771
(FRB_dom) 		4 ARG A2408
ARG A2511
VAL A2504
ASP A2512
 None
 1.00A 4xqgA-3jbzA:
undetectable		 4xqgA-3jbzA:
17.15
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3jux PROTEIN TRANSLOCASE
SUBUNIT SECA

(Thermotoga
maritima) 		PF00271
(Helicase_C)
PF01043
(SecA_PP_bind)
PF07516
(SecA_SW)
PF07517
(SecA_DEAD) 		4 ARG A 557
ASP A 447
ASP A 449
ASP A 450
 None
 1.07A 4xqgA-3juxA:
undetectable		 4xqgA-3juxA:
19.85
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.
3n2b DIAMINOPIMELATE
DECARBOXYLASE

(Vibrio cholerae) 		PF00278
(Orn_DAP_Arg_deC)
PF02784
(Orn_Arg_deC_N) 		4 ARG A 168
ASP A 177
PHE A 176
ASP A 154
 None
 1.08A 4xqgA-3n2bA:
undetectable		 4xqgA-3n2bA:
23.69
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.
3pfd ACYL-COA
DEHYDROGENASE

(Mycolicibacterium
thermoresistibile) 		PF00441
(Acyl-CoA_dh_1)
PF02770
(Acyl-CoA_dh_M)
PF02771
(Acyl-CoA_dh_N) 		4 ARG A 232
VAL A 195
ASP A 198
ASP A 199
 None
 0.81A 4xqgA-3pfdA:
undetectable		 4xqgA-3pfdA:
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.
3r20 CYTIDYLATE KINASE

(Mycolicibacterium
smegmatis) 		PF02224
(Cytidylate_kin) 		4 ARG A 132
ARG A 182
ASP A 183
ASP A 186
 None
 0.94A 4xqgA-3r20A:
undetectable		 4xqgA-3r20A:
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.
3r20 CYTIDYLATE KINASE

(Mycolicibacterium
smegmatis) 		PF02224
(Cytidylate_kin) 		4 ARG A 155
ARG A 132
ARG A 182
ASP A 186
 None
 1.13A 4xqgA-3r20A:
undetectable		 4xqgA-3r20A:
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.
3rnr STAGE II SPORULATION
E FAMILY PROTEIN

(Thermanaerovibrio
acidaminovorans) 		PF07228
(SpoIIE) 		4 ARG A 103
ASP A 162
ASP A  90
ASP A 107
 None
None
GOL  A 212 (-2.7A)
None
 0.95A 4xqgA-3rnrA:
undetectable		 4xqgA-3rnrA:
21.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3t4j HISTIDINE KINASE 4

(Arabidopsis
thaliana) 		PF03924
(CHASE) 		4 ARG A 134
ARG A 390
ASP A 367
VAL A 139
 None
 1.11A 4xqgA-3t4jA:
undetectable		 4xqgA-3t4jA:
20.47
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.
3u0b OXIDOREDUCTASE,
SHORT CHAIN
DEHYDROGENASE/REDUCT
ASE FAMILY PROTEIN

(Mycolicibacterium
smegmatis) 		PF13561
(adh_short_C2) 		4 ARG A 175
ASP A  63
ASP A 204
ASP A 202
 None
 1.12A 4xqgA-3u0bA:
6.3		 4xqgA-3u0bA:
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.
3v96 STROMELYSIN-2

(Homo sapiens) 		PF00413
(Peptidase_M10) 		4 ARG B 150
ARG B 126
ASP B 127
ASP B 130
 None
 0.87A 4xqgA-3v96B:
2.8		 4xqgA-3v96B:
16.16
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.
3w3s TYPE-2 SERINE--TRNA
LIGASE

(Methanopyrus
kandleri) 		PF00587
(tRNA-synt_2b) 		4 ARG A 109
ARG A 112
ASP A 111
VAL A 135
 None
SO4  A2020 (-3.3A)
SO4  A2020 (-4.0A)
None
 1.14A 4xqgA-3w3sA:
undetectable		 4xqgA-3w3sA:
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.
3wbz LIKELY HISTIDYL
TRNA-SPECIFIC
GUANYLYLTRANSFERASE

(Candida
albicans) 		PF04446
(Thg1)
PF14413
(Thg1C) 		4 ARG A 143
ASP A 257
ASP A 256
ASP A 252
 None
 1.04A 4xqgA-3wbzA:
undetectable		 4xqgA-3wbzA:
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.
3wjo OCTAPRENYL
DIPHOSPHATE SYNTHASE

(Escherichia
coli) 		PF00348
(polyprenyl_synt) 		4 ARG A  93
ASP A 229
ASP A  88
ASP A  85
 IPE  A 401 ( 4.2A)
None
IPE  A 401 (-3.3A)
None
 1.17A 4xqgA-3wjoA:
undetectable		 4xqgA-3wjoA:
21.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3zhr MULTIFUNCTIONAL
2-OXOGLUTARATE
METABOLISM ENZYME

(Mycolicibacterium
smegmatis) 		PF00676
(E1_dh)
PF02779
(Transket_pyr)
PF16870
(OxoGdeHyase_C) 		4 ARG A1091
ASP A1101
ASP A1081
ASP A1084
 None
 1.11A 4xqgA-3zhrA:
undetectable		 4xqgA-3zhrA:
20.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4a5p PROTEIN MXIA

(Shigella
flexneri) 		PF00771
(FHIPEP) 		4 ARG A 652
ARG A 657
VAL A 668
ASP A 660
 MLY  A 656 ( 4.7A)
None
MLY  A 656 ( 4.5A)
MLY  A 664 ( 3.1A)
 0.96A 4xqgA-4a5pA:
undetectable		 4xqgA-4a5pA:
22.02
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.
4b5m PUTATIVE
EXODEOXYRIBONUCLEASE

(Neisseria
meningitidis) 		PF03372
(Exo_endo_phos) 		4 ARG A 142
ASP A  99
PHE A 100
VAL A 145
 None
 1.10A 4xqgA-4b5mA:
undetectable		 4xqgA-4b5mA:
19.48
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.
4bub UDP-N-ACETYLMURAMOYL
-L-ALANYL-D-GLUTAMAT
E--LD-LYSINE LIGASE

(Thermotoga
maritima) 		PF01225
(Mur_ligase)
PF02875
(Mur_ligase_C)
PF08245
(Mur_ligase_M) 		4 ARG A 431
ASP A 401
PHE A 371
VAL A 449
 None
 1.17A 4xqgA-4bubA:
undetectable		 4xqgA-4bubA:
23.61
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.
4de9 PUTATIVE
TRANSCRIPTIONAL
REGULATOR YWTF

(Bacillus
subtilis) 		PF03816
(LytR_cpsA_psr) 		4 ARG A 227
ARG A  95
ASP A  97
ASP A 119
 VTP  A 401 (-2.4A)
None
VTP  A 401 (-3.8A)
None
 1.08A 4xqgA-4de9A:
undetectable		 4xqgA-4de9A:
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.
4dix PLECTIN-RELATED
PROTEIN

(Arabidopsis
thaliana) 		PF16709
(SCAB-IgPH) 		4 ARG A 435
ASP A 339
PHE A 338
ASP A 488
 None
 1.14A 4xqgA-4dixA:
undetectable		 4xqgA-4dixA:
21.89
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.
4dzi PUTATIVE TIM-BARREL
METAL-DEPENDENT
HYDROLASE

(Mycobacterium
avium) 		PF04909
(Amidohydro_2) 		4 ARG A 300
ARG A 265
ASP A 269
ASP A 264
 SO4  A 506 (-3.7A)
SO4  A 506 (-4.0A)
None
None
 1.09A 4xqgA-4dziA:
undetectable		 4xqgA-4dziA:
23.95
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.
4f7k LACCASE

(uncultured
bacterium) 		PF00394
(Cu-oxidase)
PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3) 		4 ARG A 128
VAL A 213
ASP A 161
ASP A 160
 None
 0.90A 4xqgA-4f7kA:
undetectable		 4xqgA-4f7kA:
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.
4fsf PENICILLIN-BINDING
PROTEIN 3

(Pseudomonas
aeruginosa) 		PF00905
(Transpeptidase)
PF03717
(PBP_dimer) 		4 ARG A  62
ASP A 183
VAL A 170
ASP A 169
 None
 0.93A 4xqgA-4fsfA:
undetectable		 4xqgA-4fsfA:
23.85
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.
4igg CATENIN ALPHA-1

(Homo sapiens) 		PF01044
(Vinculin) 		4 ARG A 383
ASP A 757
ASP A 509
ASP A 510
 None
 1.16A 4xqgA-4iggA:
undetectable		 4xqgA-4iggA:
20.74
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.
4jcs ENOYL-COA
HYDRATASE/ISOMERASE

(Cupriavidus
metallidurans) 		PF00378
(ECH_1) 		4 ARG A  19
ARG A  31
ASP A  27
PHE A  26
 None
 1.08A 4xqgA-4jcsA:
undetectable		 4xqgA-4jcsA:
22.79
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.
4lvn NIMP.M7 FAB HEAVY
CHAIN

(Mus musculus) 		PF07654
(C1-set)
PF07686
(V-set) 		4 ARG C  67
VAL C  86
ASP C  89
ASP C  90
 None
 0.97A 4xqgA-4lvnC:
undetectable		 4xqgA-4lvnC:
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.
4mfi SN-GLYCEROL-3-PHOSPH
ATE ABC TRANSPORTER
SUBSTRATE-BINDING
PROTEIN USPB

(Mycobacterium
tuberculosis) 		PF13416
(SBP_bac_8) 		4 ARG A 385
VAL A 386
ASP A 101
ASP A 102
 None
 0.88A 4xqgA-4mfiA:
undetectable		 4xqgA-4mfiA:
25.90
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.
4ofy PROTEIN SYG-2

(Caenorhabditis
elegans) 		PF08205
(C2-set_2)
PF13927
(Ig_3) 		4 ARG D  76
VAL D  94
ASP D  97
ASP D  98
 None
 1.00A 4xqgA-4ofyD:
undetectable		 4xqgA-4ofyD:
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.
4okq HUT OPERON POSITIVE
REGULATORY PROTEIN

(Geobacillus
thermodenitrificans) 		PF09021
(HutP) 		4 ARG A 109
ARG A  71
VAL A  65
ASP A  72
 None
 0.93A 4xqgA-4okqA:
undetectable		 4xqgA-4okqA:
15.33
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.
4r33 NOSL

(Streptomyces
actuosus) 		PF06968
(BATS) 		4 ARG A 150
ARG A 230
VAL A 222
ASP A 226
 None
SAH  A 501 (-2.9A)
None
None
 1.06A 4xqgA-4r33A:
undetectable		 4xqgA-4r33A:
24.67
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.
4rnh MOTILITY REGULATOR

(Pseudomonas
aeruginosa) 		PF00563
(EAL)
PF00990
(GGDEF) 		4 ARG A1077
VAL A1047
ASP A1050
ASP A1051
 None
 1.09A 4xqgA-4rnhA:
undetectable		 4xqgA-4rnhA:
24.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4u48 PUTATIVE INNER
MEMBRANE LIPOPROTEIN

(Salmonella
enterica) 		PF00207
(A2M)
PF01835
(A2M_N)
PF07703
(A2M_N_2)
PF10569
(Thiol-ester_cl)
PF11974
(MG1) 		4 ARG A 402
ASP A 998
ASP A 405
ASP A 403
 None
 0.98A 4xqgA-4u48A:
undetectable		 4xqgA-4u48A:
15.56
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.
4u7m LEUCINE-RICH REPEATS
AND
IMMUNOGLOBULIN-LIKE
DOMAINS PROTEIN 1

(Homo sapiens) 		PF07679
(I-set)
PF13927
(Ig_3) 		4 ARG A 647
VAL A 662
ASP A 665
ASP A 666
 None
 1.02A 4xqgA-4u7mA:
undetectable		 4xqgA-4u7mA:
20.70
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4xqe HOMOSPERMIDINE
SYNTHASE

(Blastochloris
viridis) 		PF03435
(Sacchrp_dh_NADP)
PF16653
(Sacchrp_dh_C) 		8 ARG A 139
ARG A 146
ARG A 191
ASP A 304
PHE A 305
VAL A 420
ASP A 423
ASP A 424
 AG2  A 506 ( 4.2A)
AG2  A 506 (-3.0A)
AG2  A 506 (-4.4A)
AG2  A 506 (-3.0A)
AG2  A 506 (-4.9A)
AG2  A 506 ( 4.5A)
None
AG2  A 506 (-2.4A)
 0.12A 4xqgA-4xqeA:
71.1		 4xqgA-4xqeA:
99.58
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.
4xvx ACYL-[ACYL-CARRIER-P
ROTEIN]
DEHYDROGENASE MBTN

(Mycobacterium
tuberculosis) 		PF00441
(Acyl-CoA_dh_1)
PF02770
(Acyl-CoA_dh_M)
PF02771
(Acyl-CoA_dh_N) 		4 ARG A 103
ASP A 100
ASP A 104
ASP A 107
 None
 1.12A 4xqgA-4xvxA:
undetectable		 4xqgA-4xvxA:
23.69
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.
4z6g MICROTUBULE-ACTIN
CROSS-LINKING FACTOR
1, ISOFORMS 1/2/3/5

(Homo sapiens) 		PF00307
(CH) 		4 ARG A  45
VAL A  46
ASP A 239
ASP A 242
 None
 1.09A 4xqgA-4z6gA:
undetectable		 4xqgA-4z6gA:
20.72
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.
4z85 2-NITROBENZOATE
NITROREDUCTASE

(Pseudomonas
fluorescens) 		PF01613
(Flavin_Reduct) 		4 ARG A  99
ARG A 166
ASP A 134
ASP A  93
 None
 1.09A 4xqgA-4z85A:
undetectable		 4xqgA-4z85A:
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.
4zht BIFUNCTIONAL
UDP-N-ACETYLGLUCOSAM
INE
2-EPIMERASE/N-ACETYL
MANNOSAMINE KINASE

(Homo sapiens) 		PF02350
(Epimerase_2) 		4 ARG A 321
ARG A 325
VAL A 138
ASP A 143
 UDP  A 501 (-3.1A)
None
None
None
 1.17A 4xqgA-4zhtA:
5.4		 4xqgA-4zhtA:
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.
5c2w HYPOTHETICAL (DI
HEME) PROTEIN

(Candidatus
Kuenenia
stuttgartiensis) 		PF00034
(Cytochrom_C) 		4 ARG C 143
ASP C 168
PHE C 171
ASP C 121
 HEC  C 404 (-4.2A)
HEC  C 404 (-4.1A)
None
None
 1.14A 4xqgA-5c2wC:
undetectable		 4xqgA-5c2wC:
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.
5d95 AMINOTRANSFERASE
CLASS-III

(Sphaerobacter
thermophilus) 		PF00202
(Aminotran_3) 		4 ASP A 341
PHE A 340
VAL A 270
ASP A 263
 None
 1.15A 4xqgA-5d95A:
undetectable		 4xqgA-5d95A:
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.
5exr DNA POLYMERASE ALPHA
SUBUNIT B

(Homo sapiens) 		PF04042
(DNA_pol_E_B)
PF08418
(Pol_alpha_B_N) 		4 ARG D 578
PHE D 327
VAL D 467
ASP D 536
 None
 1.10A 4xqgA-5exrD:
undetectable		 4xqgA-5exrD:
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.
5fad RIBOSOMAL PROTEIN
L11
METHYLTRANSFERASE,
PUTATIVE

(Sulfolobus
islandicus) 		PF13847
(Methyltransf_31) 		4 ARG A 124
VAL A  26
ASP A  29
ASP A  30
 None
 0.90A 4xqgA-5fadA:
5.1		 4xqgA-5fadA:
15.58
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.
5gru DIABODY PROTEIN

(Mus musculus) 		PF07686
(V-set) 		4 ARG L  67
VAL L  86
ASP L  89
ASP L  90
 ARG  L  67 ( 0.6A)
VAL  L  86 ( 0.6A)
ASP  L  89 ( 0.6A)
ASP  L  90 ( 0.6A)
 0.90A 4xqgA-5gruL:
undetectable		 4xqgA-5gruL:
17.81
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.
5gs0 HEAVY CHAIN
(ANTI-LID)

(Mus musculus) 		no annotation 4 ARG X  67
VAL X  86
ASP X  89
ASP X  90
 None
 0.78A 4xqgA-5gs0X:
undetectable		 4xqgA-5gs0X:
12.74
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.
5h5b THYMIDYLATE KINASE

(Aquifex
aeolicus) 		no annotation 4 ARG B 145
ARG B  47
ARG B  90
ASP B   9
 FLC  B 201 (-3.0A)
None
None
FLC  B 201 (-4.6A)
 1.09A 4xqgA-5h5bB:
undetectable		 4xqgA-5h5bB:
16.84
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.
5h64 SERINE/THREONINE-PRO
TEIN KINASE MTOR

(Homo sapiens) 		PF00454
(PI3_PI4_kinase)
PF02259
(FAT)
PF02260
(FATC)
PF08771
(FRB_dom)
PF11865
(DUF3385) 		4 ARG A2408
ARG A2511
VAL A2504
ASP A2512
 None
 1.13A 4xqgA-5h64A:
undetectable		 4xqgA-5h64A:
11.22
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.
5i5d INNER MEMBRANE
PROTEIN YEJM

(Salmonella
enterica) 		PF00884
(Sulfatase)
PF11893
(DUF3413) 		4 ARG A 523
ARG A 524
ASP A 493
ASP A 517
 None
 1.06A 4xqgA-5i5dA:
undetectable		 4xqgA-5i5dA:
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.
5irm UNCHARACTERIZED
PROTEIN

(Oryctolagus
cuniculus) 		PF05729
(NACHT)
PF13516
(LRR_6) 		4 ARG A 529
VAL A 555
ASP A 558
ASP A 559
 None
 0.83A 4xqgA-5irmA:
undetectable		 4xqgA-5irmA:
20.89
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.
5iv8 LPS BIOSYNTHESIS
PROTEIN

(Klebsiella
pneumoniae) 		PF04453
(OstA_C) 		4 ARG A 266
ASP A 300
ASP A 337
ASP A 341
 None
 1.08A 4xqgA-5iv8A:
undetectable		 4xqgA-5iv8A:
19.97
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.
5iv9 LPS-ASSEMBLY PROTEIN
LPTD

(Klebsiella
pneumoniae) 		PF03968
(OstA)
PF04453
(OstA_C) 		4 ARG A 243
ASP A 277
ASP A 314
ASP A 318
 None
 1.16A 4xqgA-5iv9A:
undetectable		 4xqgA-5iv9A:
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.
5jbk BETA-GLUCOSIDASE

(Trichoderma
harzianum) 		PF00232
(Glyco_hydro_1) 		4 ARG A 306
ARG A 245
PHE A 249
ASP A 314
 None
 1.14A 4xqgA-5jbkA:
undetectable		 4xqgA-5jbkA:
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.
5koi ENOYL-[ACYL-CARRIER-
PROTEIN] REDUCTASE
[NADH]

(Brucella
abortus) 		PF13561
(adh_short_C2) 		4 ARG A 219
VAL A 221
ASP A 224
ASP A 225
 None
 0.81A 4xqgA-5koiA:
8.1		 4xqgA-5koiA:
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.
5mqs BETA-L-ARABINOBIOSID
ASE

(Bacteroides
thetaiotaomicron) 		PF13088
(BNR_2) 		4 ARG A 576
ARG A 360
ASP A 458
PHE A 457
 None
 1.04A 4xqgA-5mqsA:
undetectable		 4xqgA-5mqsA:
18.09
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.
5n1q METHYL-COENZYME M
REDUCTASE III FROM
METHANOTHERMOCOCCUS
THERMOLITHOTROPHICUS
SUBUNIT BETA

(Methanothermococcus
thermolithotrophicus) 		PF02241
(MCR_beta)
PF02783
(MCR_beta_N) 		4 ARG B 426
ASP B 423
PHE B 425
VAL B 418
 None
 1.16A 4xqgA-5n1qB:
undetectable		 4xqgA-5n1qB:
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.
5tqr POLYCOMB PROTEIN EED

(Chaetomium
thermophilum) 		PF00400
(WD40) 		4 ASP A 246
PHE A 328
VAL A 193
ASP A 143
 None
 1.08A 4xqgA-5tqrA:
undetectable		 4xqgA-5tqrA:
21.42
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.
5umh CATECHOL
1,2-DIOXYGENASE

(Burkholderia
multivorans) 		PF00775
(Dioxygenase_C)
PF04444
(Dioxygenase_N) 		4 ARG A 103
ASP A  92
VAL A 301
ASP A 298
 None
 1.10A 4xqgA-5umhA:
undetectable		 4xqgA-5umhA:
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.
5v8l PGT145 ANTIBODY,
LIGHT CHAIN

(Homo sapiens) 		PF07686
(V-set) 		4 ARG N  61
VAL N  78
ASP N  81
ASP N  82
 None
 0.93A 4xqgA-5v8lN:
undetectable		 4xqgA-5v8lN:
18.85
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.
5vbl APELIN
RECEPTOR,RUBREDOXIN,
APELIN RECEPTOR
CHIMERA

(Clostridium
pasteurianum;
Homo sapiens) 		PF00001
(7tm_1)
PF00301
(Rubredoxin) 		4 ARG B 127
ASP B 126
PHE B 125
VAL B 132
 None
 1.11A 4xqgA-5vblB:
undetectable		 4xqgA-5vblB:
22.24
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5w3j TUBULIN BETA CHAIN

(Saccharomyces
cerevisiae) 		PF00091
(Tubulin)
PF03953
(Tubulin_C) 		4 ARG B  77
ASP B  74
VAL B  66
ASP B  67
 None
 1.06A 4xqgA-5w3jB:
4.1		 4xqgA-5w3jB:
23.03
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.
5wlh LBACAS13A H328A
(C2C2)

(Lachnospiraceae
bacterium
NK4A179) 		no annotation 4 ARG A 191
ASP A 212
VAL A 215
ASP A 210
 None
 1.01A 4xqgA-5wlhA:
undetectable		 4xqgA-5wlhA:
16.48
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.
5wpa SPLICING FACTOR,
PROLINE- AND
GLUTAMINE-RICH

(Homo sapiens) 		no annotation 4 ARG A 365
VAL A 364
ASP A 354
ASP A 353
 None
 0.98A 4xqgA-5wpaA:
undetectable		 4xqgA-5wpaA:
10.39
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.
5x7n DIAMINOPIMELATE
DECARBOXYLASE

(Corynebacterium
glutamicum) 		no annotation 4 ARG A  17
VAL A  29
ASP A  51
ASP A  49
 None
 1.05A 4xqgA-5x7nA:
undetectable		 4xqgA-5x7nA:
10.86
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.
5xa1 INOSITOL
1,4,5-TRISPHOSPHATE
RECEPTOR TYPE 1

(Mus musculus) 		PF01365
(RYDR_ITPR)
PF02815
(MIR)
PF08709
(Ins145_P3_rec) 		4 ASP A  55
VAL A  33
ASP A 444
ASP A 448
 None
 1.04A 4xqgA-5xa1A:
undetectable		 4xqgA-5xa1A:
14.42
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.
5yb7 L-AMINO ACID
OXIDASE/MONOOXYGENAS
E

(Pseudomonas sp.
AIU 813) 		no annotation 4 ASP A 238
PHE A 239
VAL A 228
ASP A 236
 ORN  A 602 (-3.1A)
None
None
None
 1.11A 4xqgA-5yb7A:
2.1		 4xqgA-5yb7A:
10.63
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.
6byi BETA-MANNOSIDASE

(Xanthomonas
citri) 		no annotation 4 ARG A 114
VAL A 237
ASP A 333
ASP A 331
 None
 0.89A 4xqgA-6byiA:
undetectable		 4xqgA-6byiA:
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.
6c0e ISOCITRATE
DEHYDROGENASE

(Legionella
pneumophila) 		no annotation 4 ARG A  53
ASP A 416
PHE A 414
VAL A  47
 None
 1.09A 4xqgA-6c0eA:
2.5		 4xqgA-6c0eA:
11.72
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.
6g1i -

(-) 		no annotation 4 ARG A 284
ASP A 285
VAL A 308
ASP A 312
 None
 0.96A 4xqgA-6g1iA:
undetectable		 4xqgA-6g1iA:
undetectable