SIMILAR PATTERNS OF AMINO ACIDS FOR 4USW_A_ACTA1470_0

List of similar pattern of amino acids derived from ASSAM search

Hit pattern: 3D amino acid arrangements similar to known drug binding site

Query pattern: Residues from known binding site for annotated drug that match the hit pattern


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


(Pseudomonas
putida)
PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C)
4 LEU A 212
LEU A 197
VAL A 194
PHE A 158
None
1.10A 4uswA-1bqgA:
0.0
4uswA-1bqgA:
19.73
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.
1dow ALPHA-CATENIN
BETA-CATENIN


(Mus musculus;
Mus musculus)
PF01044
(Vinculin)
no annotation
4 LYS B 133
LEU B 132
LEU A 139
VAL A 135
None
1.17A 4uswA-1dowB:
undetectable
4uswA-1dowB:
5.07
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.
1em2 MLN64 PROTEIN

(Homo sapiens)
PF01852
(START)
4 LEU A 289
LEU A 391
VAL A 390
PHE A 288
None
1.14A 4uswA-1em2A:
0.7
4uswA-1em2A:
20.42
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.
1fdj FRUCTOSE
1,6-BISPHOSPHATE
ALDOLASE


(Oryctolagus
cuniculus)
PF00274
(Glycolytic)
4 LEU A1083
LEU A1097
VAL A1104
PHE A1093
None
1.22A 4uswA-1fdjA:
0.0
4uswA-1fdjA:
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.
1g8w LEUCOAGGLUTINATING
PHYTOHEMAGGLUTININ


(Phaseolus
vulgaris)
PF00139
(Lectin_legB)
4 LYS A 100
LEU A 108
VAL A  93
PHE A 116
None
1.07A 4uswA-1g8wA:
undetectable
4uswA-1g8wA:
17.41
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.
1ijk BOTROCETIN

(Bothrops
jararaca)
PF00059
(Lectin_C)
4 LEU B 106
LEU B  55
VAL B  52
PHE B  16
None
1.14A 4uswA-1ijkB:
0.0
4uswA-1ijkB:
15.03
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.
1jct GLUCARATE
DEHYDRATASE


(Escherichia
coli)
PF13378
(MR_MLE_C)
4 LEU A 206
LEU A 191
VAL A 188
PHE A 152
None
None
None
GKR  A 499 (-4.7A)
1.03A 4uswA-1jctA:
0.0
4uswA-1jctA:
22.67
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.
1kwg BETA-GALACTOSIDASE

(Thermus
thermophilus)
PF02449
(Glyco_hydro_42)
PF08532
(Glyco_hydro_42M)
PF08533
(Glyco_hydro_42C)
4 LEU A 258
LEU A 229
VAL A 226
PHE A 237
None
1.25A 4uswA-1kwgA:
0.0
4uswA-1kwgA:
19.88
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.
1llc L-LACTATE
DEHYDROGENASE


(Lactobacillus
casei)
PF00056
(Ldh_1_N)
PF02866
(Ldh_1_C)
4 LEU A  70
LEU A  42
VAL A  41
PHE A  72
None
1.26A 4uswA-1llcA:
0.0
4uswA-1llcA:
19.71
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.
1pgj 6-PHOSPHOGLUCONATE
DEHYDROGENASE


(Trypanosoma
brucei)
PF00393
(6PGD)
PF03446
(NAD_binding_2)
4 LEU A 211
LEU A 220
VAL A 219
PHE A 203
None
1.02A 4uswA-1pgjA:
0.0
4uswA-1pgjA:
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.
1qdd LITHOSTATHINE

(Homo sapiens)
PF00059
(Lectin_C)
4 LEU A 118
LEU A  65
VAL A  62
PHE A  28
None
1.18A 4uswA-1qddA:
undetectable
4uswA-1qddA:
13.93
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.
1r9c GLUTATHIONE
TRANSFERASE


(Mesorhizobium
loti)
PF00903
(Glyoxalase)
4 LEU A 119
LEU A  91
VAL A  86
PHE A 117
None
1.09A 4uswA-1r9cA:
undetectable
4uswA-1r9cA:
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.
1ujn DEHYDROQUINATE
SYNTHASE


(Thermus
thermophilus)
PF01761
(DHQ_synthase)
4 LEU A  99
LEU A  74
VAL A  73
PHE A 102
None
1.22A 4uswA-1ujnA:
undetectable
4uswA-1ujnA:
20.77
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.
1uzn 3-OXOACYL-[ACYL-CARR
IER PROTEIN]
REDUCTASE


(Mycobacterium
tuberculosis)
PF13561
(adh_short_C2)
4 LEU A  55
LEU A  19
VAL A  20
PHE A  56
None
1.20A 4uswA-1uznA:
undetectable
4uswA-1uznA:
18.49
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.
1vpe PHOSPHOGLYCERATE
KINASE


(Thermotoga
maritima)
PF00162
(PGK)
4 LEU A  80
LEU A 112
VAL A 111
PHE A  90
None
1.10A 4uswA-1vpeA:
undetectable
4uswA-1vpeA:
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.
1wr6 ADP-RIBOSYLATION
FACTOR BINDING
PROTEIN GGA3


(Homo sapiens)
PF03127
(GAT)
4 LEU A 286
LEU A 228
VAL A 225
PHE A 252
None
1.19A 4uswA-1wr6A:
undetectable
4uswA-1wr6A:
13.19
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.
1xco PHOSPHATE
ACETYLTRANSFERASE


(Bacillus
subtilis)
PF01515
(PTA_PTB)
4 LEU A 233
LEU A 201
VAL A 265
PHE A 237
None
1.18A 4uswA-1xcoA:
undetectable
4uswA-1xcoA:
21.68
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.
1yew PARTICULATE METHANE
MONOOXYGENASE, B
SUBUNIT


(Methylococcus
capsulatus)
PF04744
(Monooxygenase_B)
4 LEU A 376
LEU A 340
VAL A 322
ARG A  43
None
1.10A 4uswA-1yewA:
undetectable
4uswA-1yewA:
21.40
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.
2b3x IRON-RESPONSIVE
ELEMENT BINDING
PROTEIN 1


(Homo sapiens)
PF00330
(Aconitase)
PF00694
(Aconitase_C)
4 LEU A 393
LEU A 526
VAL A 527
ARG A 567
None
0.96A 4uswA-2b3xA:
undetectable
4uswA-2b3xA:
19.76
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.
2bb6 TRANSCOBALAMIN II

(Bos taurus)
PF01122
(Cobalamin_bind)
4 LEU A 372
LEU A 409
VAL A 323
PHE A 357
None
1.11A 4uswA-2bb6A:
undetectable
4uswA-2bb6A:
22.99
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.
2cjw GTP-BINDING PROTEIN
GEM


(Homo sapiens)
PF00071
(Ras)
4 LYS A 210
LEU A 188
ARG A 176
PHE A 213
CAS  A 209 ( 3.0A)
CAS  A 215 ( 4.5A)
CAS  A 215 ( 4.4A)
CAS  A 209 (-4.6A)
1.02A 4uswA-2cjwA:
undetectable
4uswA-2cjwA:
19.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2e6k TRANSKETOLASE

(Thermus
thermophilus)
PF00456
(Transketolase_N)
PF02779
(Transket_pyr)
PF02780
(Transketolase_C)
4 LYS A 136
LEU A 137
LEU A 370
ARG A 330
None
1.27A 4uswA-2e6kA:
undetectable
4uswA-2e6kA:
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.
2fsw PG_0823 PROTEIN

(Porphyromonas
gingivalis)
PF01638
(HxlR)
4 LEU A  25
LEU A  90
VAL A  89
PHE A  29
None
1.06A 4uswA-2fswA:
undetectable
4uswA-2fswA:
11.73
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.
2h1y MALONYL COENZYME
A-ACYL CARRIER
PROTEIN TRANSACYLASE


(Helicobacter
pylori)
PF00698
(Acyl_transf_1)
4 LEU A 191
LEU A 166
VAL A 165
PHE A 190
None
1.25A 4uswA-2h1yA:
undetectable
4uswA-2h1yA:
20.70
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2hst EUKARYOTIC PEPTIDE
CHAIN RELEASE FACTOR
SUBUNIT 1


(Homo sapiens)
PF03464
(eRF1_2)
4 LEU A 157
LEU A 169
VAL A 168
PHE A 158
None
1.02A 4uswA-2hstA:
undetectable
4uswA-2hstA:
16.01
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.
2ie8 PHOSPHOGLYCERATE
KINASE


(Thermus
caldophilus)
PF00162
(PGK)
4 LEU A  77
LEU A 109
VAL A 108
PHE A  86
None
1.00A 4uswA-2ie8A:
undetectable
4uswA-2ie8A:
22.62
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.
2iks DNA-BINDING
TRANSCRIPTIONAL DUAL
REGULATOR


(Escherichia
coli)
PF00532
(Peripla_BP_1)
4 LEU A 250
LEU A 287
VAL A 286
PHE A 243
None
1.11A 4uswA-2iksA:
undetectable
4uswA-2iksA:
20.94
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.
2j9l CHLORIDE CHANNEL
PROTEIN 5


(Homo sapiens)
PF00571
(CBS)
4 LEU A 683
LEU A 631
VAL A 632
PHE A 634
None
1.15A 4uswA-2j9lA:
undetectable
4uswA-2j9lA:
17.67
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.
2nbh FUNGAL HYDROPHOBIN

(Schizophyllum
commune)
PF01185
(Hydrophobin)
4 LYS A  48
LEU A  50
LEU A  71
VAL A  72
None
1.24A 4uswA-2nbhA:
undetectable
4uswA-2nbhA:
12.70
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.
2qsi PUTATIVE HYDROGENASE
EXPRESSION/FORMATION
PROTEIN HUPG


(Rhodopseudomonas
palustris)
PF07449
(HyaE)
4 LEU A  36
LEU A  17
VAL A  18
PHE A  37
None
1.03A 4uswA-2qsiA:
undetectable
4uswA-2qsiA:
15.28
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.
2rbb GLYOXALASE/BLEOMYCIN
RESISTANCE
PROTEIN/DIOXYGENASE


(Paraburkholderia
phytofirmans)
PF00903
(Glyoxalase)
4 LEU A 105
LEU A 146
VAL A 145
PHE A 108
None
1.22A 4uswA-2rbbA:
undetectable
4uswA-2rbbA:
15.16
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.
2w9s DIHYDROFOLATE
REDUCTASE TYPE 1
FROM TN4003


(Staphylococcus
aureus)
PF00186
(DHFR_1)
4 LEU A   2
LEU A  40
VAL A  41
PHE A  90
None
1.08A 4uswA-2w9sA:
undetectable
4uswA-2w9sA:
15.60
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.
3fuy PUTATIVE INTEGRON
GENE CASSETTE
PROTEIN


(uncultured
bacterium)
no annotation 4 LEU A   9
LEU A  27
VAL A  26
PHE A   8
None
1.22A 4uswA-3fuyA:
undetectable
4uswA-3fuyA:
16.93
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.
3h75 PERIPLASMIC
SUGAR-BINDING DOMAIN
PROTEIN


(Pseudomonas
protegens)
PF13407
(Peripla_BP_4)
4 LEU A 169
LEU A 291
VAL A 293
PHE A 273
None
1.25A 4uswA-3h75A:
undetectable
4uswA-3h75A:
22.38
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.
3hr6 PUTATIVE
SURFACE-ANCHORED
FIMBRIAL SUBUNIT


(Corynebacterium
diphtheriae)
no annotation 4 LEU A 419
LEU A 473
VAL A 474
PHE A 356
None
1.03A 4uswA-3hr6A:
undetectable
4uswA-3hr6A:
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.
3icq EXPORTIN-T

(Schizosaccharomyces
pombe)
PF08389
(Xpo1)
4 LEU T 844
LEU T 862
VAL T 863
PHE T 846
None
1.24A 4uswA-3icqT:
undetectable
4uswA-3icqT:
19.31
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.
3ip3 OXIDOREDUCTASE,
PUTATIVE


(Thermotoga
maritima)
PF01408
(GFO_IDH_MocA)
PF02894
(GFO_IDH_MocA_C)
4 LEU A 224
LEU A 151
VAL A 152
PHE A 229
None
0.88A 4uswA-3ip3A:
undetectable
4uswA-3ip3A:
22.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3jc5 DNA REPLICATION
COMPLEX GINS PROTEIN
PSF3


(Saccharomyces
cerevisiae)
PF05916
(Sld5)
4 LEU C  46
LEU C  74
VAL C  72
PHE C  16
None
1.18A 4uswA-3jc5C:
undetectable
4uswA-3jc5C:
17.89
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.
3l4k DNA TOPOISOMERASE 2

(Saccharomyces
cerevisiae)
PF00521
(DNA_topoisoIV)
PF01751
(Toprim)
PF16898
(TOPRIM_C)
4 LEU A 682
LEU A 663
VAL A 662
PHE A 675
None
1.12A 4uswA-3l4kA:
undetectable
4uswA-3l4kA:
20.16
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.
3mzn GLUCARATE
DEHYDRATASE


(Chromohalobacter
salexigens)
PF13378
(MR_MLE_C)
4 LEU A 202
LEU A 187
VAL A 184
PHE A 148
None
None
None
SO4  A 450 (-4.7A)
1.13A 4uswA-3mznA:
undetectable
4uswA-3mznA:
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.
3pfr MANDELATE
RACEMASE/MUCONATE
LACTONIZING PROTEIN


(Actinobacillus
succinogenes)
PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C)
4 LEU A 207
LEU A 192
VAL A 189
PHE A 153
None
None
None
GKR  A 457 (-4.7A)
1.12A 4uswA-3pfrA:
undetectable
4uswA-3pfrA:
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.
3rko NADH-QUINONE
OXIDOREDUCTASE
SUBUNIT L


(Escherichia
coli)
no annotation 4 LEU L  84
LEU L 132
VAL L 131
ARG L 268
None
1.19A 4uswA-3rkoL:
undetectable
4uswA-3rkoL:
20.76
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.
3rys ADENOSINE DEAMINASE
1


(Paenarthrobacter
aurescens)
PF00962
(A_deaminase)
4 LEU A 216
VAL A 215
ARG A 184
PHE A 182
None
1.09A 4uswA-3rysA:
undetectable
4uswA-3rysA:
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.
3s51 FANCONI ANEMIA GROUP
I PROTEIN HOMOLOG


(Mus musculus)
PF14674
(FANCI_S1-cap)
PF14675
(FANCI_S1)
PF14676
(FANCI_S2)
PF14677
(FANCI_S3)
PF14678
(FANCI_S4)
PF14679
(FANCI_HD1)
PF14680
(FANCI_HD2)
4 LEU A 344
LEU A 353
VAL A 354
PHE A 349
None
1.22A 4uswA-3s51A:
undetectable
4uswA-3s51A:
17.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3teo CARBON DISULFIDE
HYDROLASE


(Acidianus sp.
A1-3)
PF00484
(Pro_CA)
4 LEU A  94
LEU A 142
VAL A 144
PHE A 138
None
1.09A 4uswA-3teoA:
undetectable
4uswA-3teoA:
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.
3v85 CYTH-LIKE
PHOSPHATASE


(Arabidopsis
thaliana)
PF01928
(CYTH)
4 LEU A  44
LEU A 118
VAL A 121
PHE A  37
None
1.23A 4uswA-3v85A:
undetectable
4uswA-3v85A:
16.70
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.
3wsv L-LACTATE
DEHYDROGENASE


(Enterococcus
mundtii)
PF00056
(Ldh_1_N)
PF02866
(Ldh_1_C)
4 LEU A 261
LEU A 306
VAL A 303
PHE A 271
None
1.05A 4uswA-3wsvA:
undetectable
4uswA-3wsvA:
22.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ze6 PERIPLASMIC [NIFESE]
HYDROGENASE, SMALL
SUBUNIT


(Desulfovibrio
vulgaris)
PF01058
(Oxidored_q6)
PF14720
(NiFe_hyd_SSU_C)
4 LEU A  43
LEU A  74
VAL A  75
PHE A  11
None
1.14A 4uswA-3ze6A:
undetectable
4uswA-3ze6A:
21.12
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3zlb PHOSPHOGLYCERATE
KINASE


(Streptococcus
pneumoniae)
PF00162
(PGK)
4 LEU A  81
LEU A 113
VAL A 112
PHE A  91
None
1.12A 4uswA-3zlbA:
undetectable
4uswA-3zlbA:
22.83
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.
4bva THIOMORPHOLINE-CARBO
XYLATE DEHYDROGENASE


(Mus musculus)
PF02423
(OCD_Mu_crystall)
4 LEU A 130
LEU A 245
VAL A 244
PHE A 289
None
1.22A 4uswA-4bvaA:
undetectable
4uswA-4bvaA:
20.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4dg5 PHOSPHOGLYCERATE
KINASE


(Staphylococcus
aureus)
PF00162
(PGK)
4 LEU A  81
LEU A 113
VAL A 112
PHE A  91
None
1.10A 4uswA-4dg5A:
undetectable
4uswA-4dg5A:
22.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4dyo ASPARTYL
AMINOPEPTIDASE


(Homo sapiens)
PF02127
(Peptidase_M18)
4 LEU A 240
LEU A 154
VAL A 155
PHE A  32
None
1.15A 4uswA-4dyoA:
undetectable
4uswA-4dyoA:
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.
4g8t GLUCARATE
DEHYDRATASE


(Actinobacillus
succinogenes)
PF13378
(MR_MLE_C)
4 LEU A 202
LEU A 187
VAL A 184
PHE A 148
None
None
None
SO4  A 501 (-4.8A)
1.14A 4uswA-4g8tA:
undetectable
4uswA-4g8tA:
22.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4gfh DNA TOPOISOMERASE 2

(Saccharomyces
cerevisiae)
PF00204
(DNA_gyraseB)
PF00521
(DNA_topoisoIV)
PF01751
(Toprim)
PF02518
(HATPase_c)
PF16898
(TOPRIM_C)
4 LEU A 682
LEU A 663
VAL A 662
PHE A 675
None
1.10A 4uswA-4gfhA:
undetectable
4uswA-4gfhA:
18.31
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4gyp GLUCARATE
DEHYDRATASE-RELATED
PROTEIN


(Escherichia
coli)
PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C)
4 LEU C 205
LEU C 190
VAL C 187
PHE C 151
None
None
None
CIT  C 501 ( 4.8A)
1.04A 4uswA-4gypC:
undetectable
4uswA-4gypC:
21.97
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.
4h5i GUANINE
NUCLEOTIDE-EXCHANGE
FACTOR SEC12


(Saccharomyces
cerevisiae)
no annotation 4 LEU A  20
LEU A  45
VAL A  44
PHE A  19
None
1.24A 4uswA-4h5iA:
undetectable
4uswA-4h5iA:
21.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4hyr GLUCARATE
DEHYDRATASE


(Acidaminococcus
intestini)
PF13378
(MR_MLE_C)
4 LEU A 202
LEU A 187
VAL A 184
PHE A 148
None
None
None
CL  A 502 ( 4.9A)
1.16A 4uswA-4hyrA:
undetectable
4uswA-4hyrA:
23.84
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.
4joq ABC RIBOSE
TRANSPORTER,
PERIPLASMIC
SOLUTE-BINDING
PROTEIN


(Rhodobacter
sphaeroides)
PF13407
(Peripla_BP_4)
4 LEU A 104
LEU A  97
VAL A  96
PHE A  99
None
1.21A 4uswA-4joqA:
undetectable
4uswA-4joqA:
20.67
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.
4k70 UL37

(Suid
alphaherpesvirus
1)
PF03970
(Herpes_UL37_1)
4 LEU A  73
LEU A 122
VAL A 123
PHE A 114
None
1.12A 4uswA-4k70A:
undetectable
4uswA-4k70A:
20.83
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.
4l5n URACIL-DNA
GLYCOSYLASE


(Human
alphaherpesvirus
1)
PF03167
(UDG)
4 LEU A 206
LEU A 226
VAL A 227
PHE A 225
None
1.23A 4uswA-4l5nA:
undetectable
4uswA-4l5nA:
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.
4ntb LEUKOTRIENE C4
SYNTHASE


(Mus musculus)
PF01124
(MAPEG)
4 LEU A  84
LEU A  18
VAL A  14
PHE A  88
None
PLM  A 206 (-4.0A)
None
None
1.23A 4uswA-4ntbA:
undetectable
4uswA-4ntbA:
16.41
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4oya ADENYLATE CYCLASE
TYPE 10


(Homo sapiens)
PF00211
(Guanylate_cyc)
5 LYS A  95
LEU A 102
LEU A 166
VAL A 167
PHE A 336
1VE  A 501 (-3.8A)
1VE  A 501 (-3.6A)
1VE  A 501 (-3.9A)
1VE  A 501 (-3.7A)
1VE  A 501 (-3.9A)
0.57A 4uswA-4oyaA:
59.9
4uswA-4oyaA:
100.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4pac HISTIDINE-CONTAINING
PHOSPHOTRANSFER
PROTEIN 2


(Arabidopsis
thaliana)
PF01627
(Hpt)
4 LEU A 128
LEU A 143
VAL A 140
PHE A 147
None
1.26A 4uswA-4pacA:
undetectable
4uswA-4pacA:
19.05
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.
4wfi CUTINASE

(Saccharomonospora
viridis)
PF03403
(PAF-AH_p_II)
4 LEU A 153
VAL A 154
ARG A 156
PHE A  77
None
1.10A 4uswA-4wfiA:
undetectable
4uswA-4wfiA:
19.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4wtx INTEGRIN BETA-4

(Homo sapiens)
PF00041
(fn3)
4 LEU A1589
LEU A1605
VAL A1646
PHE A1620
None
1.15A 4uswA-4wtxA:
undetectable
4uswA-4wtxA:
12.59
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.
4z8z UNCHARACTERIZED
PROTEIN


(Ruminiclostridium
thermocellum)
no annotation 4 LYS A 310
LEU A 311
LEU A 296
VAL A 267
None
0.92A 4uswA-4z8zA:
undetectable
4uswA-4z8zA:
21.46
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.
4zkq PUTATIVE
UNCHARACTERIZED
PROTEIN


(Cricetid
gammaherpesvirus
2)
no annotation 4 LYS A 319
LEU A 318
LEU A 400
VAL A 399
None
1.06A 4uswA-4zkqA:
undetectable
4uswA-4zkqA:
23.09
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.
5co1 PROTOCADHERIN-19
ISOFORM 1


(Danio rerio)
PF00028
(Cadherin)
4 LEU A 373
LEU A 347
VAL A 348
PHE A 376
None
1.11A 4uswA-5co1A:
undetectable
4uswA-5co1A:
20.00
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.
5cwv NUCLEOPORIN NUP192

(Chaetomium
thermophilum)
PF11894
(Nup192)
4 LEU A1632
LEU A1617
VAL A1618
ARG A1628
None
1.21A 4uswA-5cwvA:
undetectable
4uswA-5cwvA:
20.45
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5huc 3-DEOXY-D-ARABINO-HE
PTULOSONATE
7-PHOSPHATE (DAHP)
SYNTHASE


(Corynebacterium
glutamicum)
PF01474
(DAHP_synth_2)
4 LEU A 123
LEU A 465
VAL A 466
PHE A 464
None
1.23A 4uswA-5hucA:
undetectable
4uswA-5hucA:
22.26
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.
5i2x ADRENOCORTICAL
DYSPLASIA PROTEIN
HOMOLOG


(Homo sapiens)
PF10341
(TPP1)
4 LEU A 183
LEU A 117
VAL A 146
PHE A 208
None
1.24A 4uswA-5i2xA:
undetectable
4uswA-5i2xA:
15.55
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.
5i5j NITROUS-OXIDE
REDUCTASE


(Shewanella
denitrificans)
no annotation 4 LEU A 214
LEU A 299
VAL A 298
PHE A 215
None
1.19A 4uswA-5i5jA:
undetectable
4uswA-5i5jA:
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.
5ig8 ATP GRASP LIGASE

(Microcystis
aeruginosa)
no annotation 4 LYS A 131
LEU A 132
LEU A 172
VAL A 209
None
1.12A 4uswA-5ig8A:
undetectable
4uswA-5ig8A:
22.62
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.
5ijx TYROSINE--TRNA
LIGASE,
MITOCHONDRIAL


(Coccidioides
posadasii)
PF00579
(tRNA-synt_1b)
4 LEU A  83
LEU A  91
VAL A  92
PHE A  85
None
1.27A 4uswA-5ijxA:
undetectable
4uswA-5ijxA:
20.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ix8 PUTATIVE SUGAR ABC
TRANSPORT SYSTEM,
SUBSTRATE-BINDING
PROTEIN


(Bordetella
parapertussis)
PF13407
(Peripla_BP_4)
4 LEU A 119
LEU A 134
VAL A 131
PHE A 109
None
1.07A 4uswA-5ix8A:
undetectable
4uswA-5ix8A:
21.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5jm6 AMINOPEPTIDASE-LIKE
PROTEIN


(Chaetomium
thermophilum)
PF02127
(Peptidase_M18)
4 LEU A 282
LEU A 194
VAL A 195
PHE A  69
None
1.04A 4uswA-5jm6A:
undetectable
4uswA-5jm6A:
22.77
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.
5jsy PERIPLASMIC [NIFESE]
HYDROGENASE, SMALL
SUBUNIT


(Desulfovibrio
vulgaris)
PF01058
(Oxidored_q6)
PF14720
(NiFe_hyd_SSU_C)
4 LEU A  43
LEU A  74
VAL A  75
PHE A  11
None
1.19A 4uswA-5jsyA:
undetectable
4uswA-5jsyA:
20.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5k51 HYPOXANTHINE-GUANINE
PHOSPHORIBOSYLTRANSF
ERASE


(Trypanosoma
brucei)
PF00156
(Pribosyltran)
4 LEU A  79
LEU A 112
VAL A 111
PHE A  78
None
1.23A 4uswA-5k51A:
undetectable
4uswA-5k51A:
18.67
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.
5lm8 'MULTICOPPER OXIDASE

(Aspergillus
niger)
PF00394
(Cu-oxidase)
PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3)
4 LEU A 460
LEU A 438
VAL A 437
PHE A 457
None
1.22A 4uswA-5lm8A:
undetectable
4uswA-5lm8A:
22.54
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.
5m7o NITROGEN
ASSIMILATION
REGULATORY PROTEIN


(Brucella
abortus)
PF00072
(Response_reg)
PF00158
(Sigma54_activat)
PF02954
(HTH_8)
4 LEU A 355
LEU A 142
VAL A 143
ARG A 312
None
1.26A 4uswA-5m7oA:
undetectable
4uswA-5m7oA:
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.
5mkk MULTIDRUG RESISTANCE
ABC TRANSPORTER
ATP-BINDING AND
PERMEASE PROTEIN


(Thermus
thermophilus)
PF00005
(ABC_tran)
PF00664
(ABC_membrane)
4 LEU A 440
VAL A 439
ARG A 509
PHE A 444
None
0.91A 4uswA-5mkkA:
undetectable
4uswA-5mkkA:
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.
5mlp UNCHARACTERIZED
PROTEIN


(Rickettsiella
grylli)
no annotation 4 LEU A  25
LEU A 109
VAL A 110
PHE A  58
None
1.02A 4uswA-5mlpA:
undetectable
4uswA-5mlpA:
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.
5mp7 RIBOSE-PHOSPHATE
PYROPHOSPHOKINASE


(Mycolicibacterium
smegmatis)
PF13793
(Pribosyltran_N)
PF14572
(Pribosyl_synth)
4 LEU A  64
LEU A  31
VAL A  27
PHE A  62
None
1.17A 4uswA-5mp7A:
undetectable
4uswA-5mp7A:
21.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5n8o DNA HELICASE I

(Escherichia
coli)
PF07057
(TraI)
PF08751
(TrwC)
PF13604
(AAA_30)
4 LEU A1066
LEU A1069
VAL A1095
PHE A1067
None
1.25A 4uswA-5n8oA:
undetectable
4uswA-5n8oA:
13.80
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.
5oen SIGNAL TRANSDUCER
AND ACTIVATOR OF
TRANSCRIPTION


(Mus musculus)
no annotation 4 LEU B 269
LEU B 226
VAL B 227
PHE B 268
None
1.20A 4uswA-5oenB:
undetectable
4uswA-5oenB:
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.
5ovk 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
REDUCTASE FABG


(Mycolicibacterium
smegmatis)
no annotation 4 LEU A  63
LEU A  27
VAL A  28
PHE A  64
None
1.26A 4uswA-5ovkA:
undetectable
4uswA-5ovkA:
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.
5u22 N2152

(Neocallimastix
frontalis)
PF01229
(Glyco_hydro_39)
4 LEU A  55
LEU A  66
VAL A  67
ARG A  98
None
1.25A 4uswA-5u22A:
undetectable
4uswA-5u22A:
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.
5ufm METHYLTRANSFERASE
DOMAIN PROTEIN


(Burkholderia
thailandensis)
no annotation 4 LEU A  60
LEU A  71
VAL A  70
PHE A 163
None
1.10A 4uswA-5ufmA:
undetectable
4uswA-5ufmA:
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.
5ulu CADHERIN-23

(Mus musculus)
no annotation 4 LEU A2032
LEU A1958
VAL A1957
PHE A2033
None
0.97A 4uswA-5uluA:
undetectable
4uswA-5uluA:
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.
5uxv SENSORY TRANSDUCTION
REGULATORY PROTEIN


(Bartonella
quintana)
no annotation 4 LEU A 189
LEU A 236
VAL A 237
PHE A 217
None
0.97A 4uswA-5uxvA:
undetectable
4uswA-5uxvA:
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.
5v12 HERCYNYLCYSTEINE
SULFOXIDE LYASE


(Neurospora
crassa)
no annotation 4 LEU C 399
LEU C 352
ARG C 434
PHE C 376
None
1.22A 4uswA-5v12C:
undetectable
4uswA-5v12C:
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.
5wmm NRPS

(Micromonospora
sp. ML1)
no annotation 4 LEU A 877
VAL A 878
ARG A 421
PHE A 423
None
None
None
CA  A1008 ( 4.4A)
1.06A 4uswA-5wmmA:
undetectable
4uswA-5wmmA:
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.
5xfo PHD FINGER PROTEIN 1

(Homo sapiens)
PF00628
(PHD)
4 LEU A 305
LEU A 259
VAL A 258
PHE A 329
None
1.00A 4uswA-5xfoA:
undetectable
4uswA-5xfoA:
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.
5xmc E3 UBIQUITIN-PROTEIN
LIGASE ITCHY


(Mus musculus)
PF00397
(WW)
PF00632
(HECT)
4 LEU A 368
VAL A 800
ARG A 797
PHE A 375
None
1.27A 4uswA-5xmcA:
undetectable
4uswA-5xmcA:
20.03
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.
6c2h CYSTATHIONINE
BETA-SYNTHASE


(Saccharomyces
cerevisiae)
no annotation 4 LYS A 335
LEU A 334
LEU A 345
VAL A 344
None
1.16A 4uswA-6c2hA:
undetectable
4uswA-6c2hA:
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.
6cxh PARTICULATE METHANE
MONOOXYGENASE, B
SUBUNIT


(Methylomicrobium
alcaliphilum)
no annotation 4 LEU A 376
LEU A 340
VAL A 322
ARG A  43
None
1.21A 4uswA-6cxhA:
undetectable
4uswA-6cxhA:
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.
6eu6 AMMONIUM TRANSPORTER

(Candidatus
Kuenenia
stuttgartiensis)
no annotation 4 LEU A 399
VAL A 390
ARG A  46
PHE A 121
SO4  A 507 ( 3.7A)
LMT  A 504 ( 4.2A)
SO4  A 507 (-3.6A)
SO4  A 507 ( 4.5A)
1.25A 4uswA-6eu6A:
undetectable
4uswA-6eu6A:
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.
6f85 CYTOCHROME P450
CYP260A1


(Sorangium
cellulosum)
no annotation 4 LEU A 205
LEU A 226
VAL A 223
PHE A  91
None
HEM  A 501 (-4.5A)
None
None
1.24A 4uswA-6f85A:
undetectable
4uswA-6f85A:
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.
6fhv GLUCOAMYLASE

(Penicillium
oxalicum)
no annotation 4 LEU A 358
LEU A 423
VAL A 424
PHE A 420
None
1.02A 4uswA-6fhvA:
undetectable
4uswA-6fhvA:
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.
6fkh ATP SYNTHASE GAMMA
CHAIN, CHLOROPLASTIC


(Spinacia
oleracea)
no annotation 4 LEU g 201
LEU g 231
VAL g 210
PHE g 199
None
1.23A 4uswA-6fkhg:
undetectable
4uswA-6fkhg:
undetectable