SIMILAR PATTERNS OF AMINO ACIDS FOR 3AG2_J_CHDJ60

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.
1cly IGG FAB (HUMAN IGG1,
KAPPA)


(Homo sapiens)
PF07654
(C1-set)
PF07686
(V-set)
4 TYR H  91
MET H  89
THR H 107
LEU H 108
None
1.43A 3ag2J-1clyH:
undetectable
3ag2J-1clyH:
16.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1clz IGG FAB (IGG3,
KAPPA)


(Mus musculus)
PF07654
(C1-set)
PF07686
(V-set)
4 TYR H  91
MET H  89
THR H 107
LEU H 108
None
1.41A 3ag2J-1clzH:
0.0
3ag2J-1clzH:
15.38
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.
1dlc DELTA-ENDOTOXIN
CRYIIIA


(Bacillus
thuringiensis)
PF00555
(Endotoxin_M)
PF03944
(Endotoxin_C)
PF03945
(Endotoxin_N)
4 TYR A 268
ARG A 269
MET A 272
THR A 273
None
1.25A 3ag2J-1dlcA:
0.0
3ag2J-1dlcA:
7.37
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.
1ej6 LAMBDA1

(Reovirus sp.)
no annotation 4 TYR B 407
MET B 406
THR B 453
LEU B 262
None
1.24A 3ag2J-1ej6B:
0.0
3ag2J-1ej6B:
4.24
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.
1ep2 DIHYDROOROTATE
DEHYDROGENASE B
(PYRK SUBUNIT)


(Lactococcus
lactis)
PF00175
(NAD_binding_1)
PF10418
(DHODB_Fe-S_bind)
4 TYR B  71
MET B  23
THR B  68
LEU B  25
None
1.43A 3ag2J-1ep2B:
undetectable
3ag2J-1ep2B:
17.79
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.
1flo FLP RECOMBINASE

(Saccharomyces
cerevisiae)
PF03930
(Flp_N)
PF05202
(Flp_C)
4 ARG A 308
MET A 311
THR A 312
LEU A 315
None
0.97A 3ag2J-1floA:
0.0
3ag2J-1floA:
9.80
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.
1iw8 ACID PHOSPHATASE

(Shimwellia
blattae)
PF01569
(PAP2)
4 TYR A  18
MET A 102
THR A 100
LEU A  99
None
1.19A 3ag2J-1iw8A:
0.0
3ag2J-1iw8A:
17.37
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.
1khc DNA CYTOSINE-5
METHYLTRANSFERASE
3B2


(Mus musculus)
PF00855
(PWWP)
4 TYR A 305
ARG A 306
MET A 309
LEU A 313
None
1.02A 3ag2J-1khcA:
undetectable
3ag2J-1khcA:
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.
1lrw METHANOL
DEHYDROGENASE
SUBUNIT 1


(Paracoccus
denitrificans)
PF01011
(PQQ)
PF13360
(PQQ_2)
4 ARG A 383
MET A 416
THR A 437
LEU A 436
None
0.90A 3ag2J-1lrwA:
undetectable
3ag2J-1lrwA:
6.95
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.
1lrw METHANOL
DEHYDROGENASE
SUBUNIT 1


(Paracoccus
denitrificans)
PF01011
(PQQ)
PF13360
(PQQ_2)
4 ARG A 446
MET A 438
THR A 437
LEU A 436
None
1.32A 3ag2J-1lrwA:
undetectable
3ag2J-1lrwA:
6.95
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.
1mro METHYL-COENZYME M
REDUCTASE


(Methanothermobacter
marburgensis)
PF02249
(MCR_alpha)
PF02745
(MCR_alpha_N)
4 TYR A 338
ARG A 526
MET A 313
THR A 310
None
1.21A 3ag2J-1mroA:
undetectable
3ag2J-1mroA:
8.11
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.
1ufo HYPOTHETICAL PROTEIN
TT1662


(Thermus
thermophilus)
no annotation 4 ARG A 190
MET A 191
THR A 194
LEU A 195
None
1.44A 3ag2J-1ufoA:
undetectable
3ag2J-1ufoA:
12.34
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.
1ug3 EUKARYOTIC PROTEIN
SYNTHESIS INITIATION
FACTOR 4G


(Homo sapiens)
PF02020
(W2)
PF02847
(MA3)
4 ARG A1481
MET A1484
THR A1485
LEU A1529
None
1.45A 3ag2J-1ug3A:
undetectable
3ag2J-1ug3A:
9.25
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.
1vcz RNASE NGR3

(Nicotiana
glutinosa)
PF00445
(Ribonuclease_T2)
4 ARG A 116
MET A  72
THR A  71
LEU A  68
None
1.04A 3ag2J-1vczA:
undetectable
3ag2J-1vczA:
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.
1wzo HPCE

(Thermus
thermophilus)
PF01557
(FAA_hydrolase)
4 ARG A 110
MET A 203
THR A 204
LEU A 205
None
1.43A 3ag2J-1wzoA:
undetectable
3ag2J-1wzoA:
15.48
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.
1x53 ACTIVATOR OF 90 KDA
HEAT SHOCK PROTEIN
ATPASE HOMOLOG 1


(Homo sapiens)
PF08327
(AHSA1)
4 ARG A 109
MET A 106
THR A  92
LEU A  93
None
1.43A 3ag2J-1x53A:
undetectable
3ag2J-1x53A:
21.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2b39 C3

(Bos taurus)
PF00207
(A2M)
PF01759
(NTR)
PF01821
(ANATO)
PF01835
(A2M_N)
PF07677
(A2M_recep)
PF07678
(A2M_comp)
PF07703
(A2M_N_2)
PF10569
(Thiol-ester_cl)
4 TYR A1179
ARG A1205
THR A1207
LEU A1210
None
1.19A 3ag2J-2b39A:
undetectable
3ag2J-2b39A:
3.49
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.
2bkx GLUCOSAMINE-6-PHOSPH
ATE DEAMINASE


(Bacillus
subtilis)
PF01182
(Glucosamine_iso)
4 TYR A 116
MET A 182
THR A 181
LEU A  66
None
None
None
F6R  A1243 (-4.0A)
1.38A 3ag2J-2bkxA:
undetectable
3ag2J-2bkxA:
10.66
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.
2c6w PENICILLIN-BINDING
PROTEIN 1A


(Streptococcus
pneumoniae)
PF00905
(Transpeptidase)
4 TYR B 618
ARG B 619
MET B 622
THR B 623
None
0.91A 3ag2J-2c6wB:
undetectable
3ag2J-2c6wB:
8.29
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.
2cxe RIBULOSE
BISPHOSPHATE
CARBOXYLASE


(Pyrococcus
horikoshii)
PF00016
(RuBisCO_large)
PF02788
(RuBisCO_large_N)
4 ARG A 328
MET A 295
THR A 294
LEU A 298
None
1.44A 3ag2J-2cxeA:
undetectable
3ag2J-2cxeA:
10.97
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.
2fe8 REPLICASE
POLYPROTEIN 1AB


(Severe acute
respiratory
syndrome-related
coronavirus)
PF08715
(Viral_protease)
4 ARG A 167
MET A 170
THR A 171
LEU A 174
None
0.65A 3ag2J-2fe8A:
undetectable
3ag2J-2fe8A:
10.79
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.
2mhl OUTER MEMBRANE
PROTEIN W


(Escherichia
coli)
PF03922
(OmpW)
4 TYR A 190
MET A   9
THR A  43
LEU A  42
None
1.44A 3ag2J-2mhlA:
undetectable
3ag2J-2mhlA:
13.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2nts TRBC1 PROTEIN

(Homo sapiens)
PF07654
(C1-set)
PF07686
(V-set)
4 ARG P  68
MET P  77
THR P  20
LEU P  21
None
1.39A 3ag2J-2ntsP:
undetectable
3ag2J-2ntsP:
11.30
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.
2ocd L-ASPARAGINASE I

(Vibrio cholerae)
PF00710
(Asparaginase)
4 ARG A 157
MET A 335
THR A 336
LEU A 337
None
1.26A 3ag2J-2ocdA:
undetectable
3ag2J-2ocdA:
11.04
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.
2rb9 HYPE PROTEIN

(Escherichia
coli)
PF00586
(AIRS)
PF02769
(AIRS_C)
4 TYR A  93
ARG A  92
MET A 150
LEU A  53
None
1.28A 3ag2J-2rb9A:
undetectable
3ag2J-2rb9A:
13.24
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.
2rdx MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME,
PUTATIVE


(Roseovarius
nubinhibens)
PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C)
4 TYR A 159
MET A 135
THR A 320
LEU A 342
None
1.42A 3ag2J-2rdxA:
undetectable
3ag2J-2rdxA:
11.59
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.
2uvf EXOPOLYGALACTURONASE

(Yersinia
enterocolitica)
PF00295
(Glyco_hydro_28)
PF12708
(Pectate_lyase_3)
4 TYR A 375
MET A 433
THR A 461
LEU A 460
None
1.44A 3ag2J-2uvfA:
undetectable
3ag2J-2uvfA:
8.13
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.
2x0q ALCALIGIN
BIOSYNTHESIS PROTEIN


(Bordetella
bronchiseptica)
PF04183
(IucA_IucC)
PF06276
(FhuF)
4 TYR A 511
MET A 395
THR A 394
LEU A 455
None
1.36A 3ag2J-2x0qA:
undetectable
3ag2J-2x0qA:
11.83
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.
2xfa ACTIN
DEPOLYMERIZATION
FACTOR 2


(Plasmodium
berghei)
PF00241
(Cofilin_ADF)
4 TYR A  88
ARG A  86
MET A  74
LEU A  51
None
1.43A 3ag2J-2xfaA:
undetectable
3ag2J-2xfaA:
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.
2xhe SYNTAXIN1

(Monosiga
brevicollis)
PF00804
(Syntaxin)
PF05739
(SNARE)
4 TYR B 154
MET B  94
THR B  93
LEU B  90
None
1.36A 3ag2J-2xheB:
undetectable
3ag2J-2xheB:
13.69
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2y69 CYTOCHROME C OXIDASE
POLYPEPTIDE 7A1


(Bos taurus)
PF02238
(COX7a)
5 TYR J  32
ARG J  33
MET J  36
THR J  37
LEU J  40
None
0.47A 3ag2J-2y69J:
8.0
3ag2J-2y69J:
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.
2yv3 ASPARTATE-SEMIALDEHY
DE DEHYDROGENASE


(Thermus
thermophilus)
PF01118
(Semialdhyde_dh)
PF02774
(Semialdhyde_dhC)
4 TYR A 276
MET A 278
THR A 281
LEU A 280
None
1.32A 3ag2J-2yv3A:
undetectable
3ag2J-2yv3A:
10.24
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.
2ziu MUS81 PROTEIN

(Danio rerio)
PF02732
(ERCC4)
4 TYR A 471
MET A 475
THR A 476
LEU A 479
None
0.81A 3ag2J-2ziuA:
undetectable
3ag2J-2ziuA:
10.29
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.
3b7y E3 UBIQUITIN-PROTEIN
LIGASE NEDD4


(Homo sapiens)
PF00168
(C2)
4 ARG A 124
MET A 248
THR A 249
LEU A 213
None
1.38A 3ag2J-3b7yA:
undetectable
3ag2J-3b7yA:
21.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3b8l UNCHARACTERIZED
PROTEIN


(Novosphingobium
aromaticivorans)
PF13577
(SnoaL_4)
4 TYR A 112
MET A 130
THR A 129
LEU A  43
GOL  A 145 (-4.4A)
GOL  A 145 ( 3.8A)
None
None
1.27A 3ag2J-3b8lA:
undetectable
3ag2J-3b8lA:
15.24
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.
3ci0 PSEUDOPILIN GSPJ

(Escherichia
coli)
PF11612
(T2SSJ)
4 ARG J  92
MET J  58
THR J  56
LEU J 188
None
1.40A 3ag2J-3ci0J:
undetectable
3ag2J-3ci0J:
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.
3cmm UBIQUITIN-ACTIVATING
ENZYME E1 1


(Saccharomyces
cerevisiae)
PF00899
(ThiF)
PF09358
(E1_UFD)
PF10585
(UBA_e1_thiolCys)
PF16190
(E1_FCCH)
PF16191
(E1_4HB)
4 TYR A 959
MET A1001
THR A1000
LEU A1024
None
1.22A 3ag2J-3cmmA:
undetectable
3ag2J-3cmmA:
5.08
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.
3h7o GROUP 3 ALLERGEN
SMIPP-S YV6023A04


(Sarcoptes
scabiei)
PF00089
(Trypsin)
4 TYR A  82
ARG A  83
MET A  87
THR A  86
None
1.16A 3ag2J-3h7oA:
undetectable
3ag2J-3h7oA:
12.12
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.
3i7d SUGAR PHOSPHATE
ISOMERASE


(Ruegeria
pomeroyi)
PF07883
(Cupin_2)
4 TYR A 128
MET A 133
THR A 145
LEU A 152
CAC  A 164 (-4.3A)
None
None
None
1.41A 3ag2J-3i7dA:
undetectable
3ag2J-3i7dA:
16.78
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.
3ig2 PHENYLALANYL-TRNA
SYNTHETASE BETA
CHAIN


(Bacteroides
fragilis)
no annotation 4 TYR A 593
MET A 561
THR A 531
LEU A 530
None
1.09A 3ag2J-3ig2A:
undetectable
3ag2J-3ig2A:
16.23
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.
3k13 5-METHYLTETRAHYDROFO
LATE-HOMOCYSTEINE
METHYLTRANSFERASE


(Bacteroides
thetaiotaomicron)
PF00809
(Pterin_bind)
4 ARG A 407
MET A 410
THR A 411
LEU A 414
None
0.70A 3ag2J-3k13A:
undetectable
3ag2J-3k13A:
11.46
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.
3nab FAB15 MUT6 HEAVY
CHAIN


(Homo sapiens)
PF07654
(C1-set)
PF07686
(V-set)
4 TYR H  91
MET H  89
THR H 107
LEU H 108
None
1.32A 3ag2J-3nabH:
undetectable
3ag2J-3nabH:
14.86
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.
3p8c NCK-ASSOCIATED
PROTEIN 1


(Homo sapiens)
PF09735
(Nckap1)
4 ARG B 149
MET B 144
THR B 142
LEU B 143
None
1.33A 3ag2J-3p8cB:
undetectable
3ag2J-3p8cB:
4.26
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.
3qp9 TYPE I POLYKETIDE
SYNTHASE PIKAII


(Streptomyces
venezuelae)
PF08659
(KR)
4 ARG A 181
MET A 187
THR A 188
LEU A 191
None
1.08A 3ag2J-3qp9A:
undetectable
3ag2J-3qp9A:
7.05
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.
3qqz PUTATIVE
UNCHARACTERIZED
PROTEIN YJIK


(Escherichia
coli)
PF06977
(SdiA-regulated)
4 ARG A 130
MET A 122
THR A 108
LEU A 109
None
1.27A 3ag2J-3qqzA:
undetectable
3ag2J-3qqzA:
12.24
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.
3se7 VANA

(-)
PF01820
(Dala_Dala_lig_N)
PF07478
(Dala_Dala_lig_C)
4 TYR A 315
MET A 319
THR A 320
LEU A 324
None
0.93A 3ag2J-3se7A:
undetectable
3ag2J-3se7A:
10.15
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.
3tat TYROSINE
AMINOTRANSFERASE


(Escherichia
coli)
PF00155
(Aminotran_1_2)
4 ARG A 374
MET A  21
THR A  19
LEU A  18
None
1.37A 3ag2J-3tatA:
undetectable
3ag2J-3tatA:
8.82
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.
3uji FAB REGION OF THE
HEAVY CHAIN OF
ANTI-HIV-1 V3
MONOCLONAL ANTIBODY
2558


(Homo sapiens)
PF07654
(C1-set)
PF07686
(V-set)
4 TYR H  91
MET H  89
THR H 107
LEU H 108
None
1.43A 3ag2J-3ujiH:
undetectable
3ag2J-3ujiH:
13.89
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.
3zxs CRYPTOCHROME B

(Rhodobacter
sphaeroides)
PF04244
(DPRP)
4 TYR A 439
ARG A 343
MET A 344
LEU A 347
None
None
SF4  A1510 (-4.5A)
None
1.17A 3ag2J-3zxsA:
undetectable
3ag2J-3zxsA:
8.48
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.
4bht NADP-SPECIFIC
GLUTAMATE
DEHYDROGENASE


(Escherichia
coli)
PF00208
(ELFV_dehydrog)
PF02812
(ELFV_dehydrog_N)
4 ARG A 156
MET A 151
THR A 152
LEU A 150
GOL  A1450 (-3.6A)
None
None
None
1.41A 3ag2J-4bhtA:
undetectable
3ag2J-4bhtA:
8.84
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.
4d7x MEDIATOR OF RNA
POLYMERASE II
TRANSCRIPTION
SUBUNIT 15


([Candida]
glabrata)
PF16987
(KIX_2)
4 ARG A  76
MET A  24
THR A  21
LEU A  20
None
1.38A 3ag2J-4d7xA:
undetectable
3ag2J-4d7xA:
18.60
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.
4f62 GERANYLTRANSTRANSFER
ASE


(Marinomonas sp.
MED121)
PF00348
(polyprenyl_synt)
4 TYR A  17
ARG A  13
THR A  65
LEU A  64
None
1.42A 3ag2J-4f62A:
undetectable
3ag2J-4f62A:
10.09
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.
4hwe FAB HEAVY CHAIN

(Homo sapiens)
PF07654
(C1-set)
PF07686
(V-set)
4 TYR H  96
MET H  94
THR H 113
LEU H 114
None
1.37A 3ag2J-4hweH:
undetectable
3ag2J-4hweH:
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.
4ina SACCHAROPINE
DEHYDROGENASE


(Wolinella
succinogenes)
PF03435
(Sacchrp_dh_NADP)
PF16653
(Sacchrp_dh_C)
4 TYR A 103
MET A  93
THR A  91
LEU A  90
None
1.14A 3ag2J-4inaA:
undetectable
3ag2J-4inaA:
9.63
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.
4k0u LIPOPROTEIN OUTS

(Dickeya
dadantii)
PF09691
(T2SS_PulS_OutS)
4 ARG A 120
MET A 122
THR A 123
LEU A 126
None
1.14A 3ag2J-4k0uA:
undetectable
3ag2J-4k0uA:
20.39
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.
4k3b OUTER MEMBRANE
PROTEIN ASSEMBLY
FACTOR BAMA


(Neisseria
gonorrhoeae)
PF01103
(Bac_surface_Ag)
PF07244
(POTRA)
4 TYR A 296
MET A 301
THR A 302
LEU A 305
None
0.99A 3ag2J-4k3bA:
undetectable
3ag2J-4k3bA:
5.95
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.
4kmr TRANSCRIPTIONAL
REGULATOR, LACI
FAMILY


(Sanguibacter
keddieii)
PF13377
(Peripla_BP_3)
4 TYR A 208
ARG A 209
THR A 213
LEU A 217
None
1.21A 3ag2J-4kmrA:
undetectable
3ag2J-4kmrA:
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.
4kxb GLUTAMYL
AMINOPEPTIDASE


(Homo sapiens)
PF01433
(Peptidase_M1)
PF11838
(ERAP1_C)
4 ARG A 143
MET A 190
THR A 189
LEU A 188
None
0.97A 3ag2J-4kxbA:
undetectable
3ag2J-4kxbA:
5.38
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.
4l0o CYSTATHIONINE
GAMMA-SYNTHASE


(Helicobacter
pylori)
no annotation 4 ARG H   2
MET H   3
THR H   5
LEU H   7
None
1.21A 3ag2J-4l0oH:
undetectable
3ag2J-4l0oH:
11.01
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.
4ly4 PEPTIDOGLYCAN
DEACETYLASE


(Helicobacter
pylori)
PF01522
(Polysacc_deac_1)
4 TYR A   9
MET A 244
THR A 245
LEU A 198
None
1.24A 3ag2J-4ly4A:
undetectable
3ag2J-4ly4A:
10.43
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.
4n2x DL-2-HALOACID
DEHALOGENASE


(Methylobacterium
sp. CPA1)
PF10778
(DehI)
4 ARG A 249
MET A 251
THR A 252
LEU A 255
None
1.01A 3ag2J-4n2xA:
undetectable
3ag2J-4n2xA:
11.99
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.
4oqr CYP105AS1

(Amycolatopsis
orientalis)
PF00067
(p450)
4 ARG A  40
MET A  39
THR A  13
LEU A  14
None
1.34A 3ag2J-4oqrA:
undetectable
3ag2J-4oqrA:
11.18
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.
4r8l UNCHARACTERIZED
PROTEIN


(Cavia porcellus)
PF00710
(Asparaginase)
4 ARG A 182
MET A 358
THR A 359
LEU A 360
None
1.27A 3ag2J-4r8lA:
undetectable
3ag2J-4r8lA:
11.04
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.
4rm7 ACYL-COA
DEHYDROGENASE


(Slackia
heliotrinireducens)
PF00441
(Acyl-CoA_dh_1)
PF02770
(Acyl-CoA_dh_M)
PF02771
(Acyl-CoA_dh_N)
4 TYR A 322
MET A 295
THR A 293
LEU A 292
None
1.19A 3ag2J-4rm7A:
undetectable
3ag2J-4rm7A:
12.38
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.
4rwt LEIOMODIN-2

(Homo sapiens)
no annotation 4 ARG C 309
MET C 312
THR C 313
LEU C 316
None
0.93A 3ag2J-4rwtC:
undetectable
3ag2J-4rwtC:
9.30
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.
4upk PHOSPHONATE
MONOESTER HYDROLASE


(Ruegeria
pomeroyi)
PF00884
(Sulfatase)
4 TYR A 257
MET A 332
THR A 333
LEU A 406
None
1.23A 3ag2J-4upkA:
undetectable
3ag2J-4upkA:
8.05
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.
4wuu IMMUNOGLOBULIN HEAVY
CHAIN


(Homo sapiens)
PF07654
(C1-set)
PF07686
(V-set)
4 TYR E  95
MET E  93
THR E 115
LEU E 116
None
1.40A 3ag2J-4wuuE:
undetectable
3ag2J-4wuuE:
14.35
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.
4zi6 CYTOSOL
AMINOPEPTIDASE


(Helicobacter
pylori)
PF00883
(Peptidase_M17)
PF02789
(Peptidase_M17_N)
4 TYR A 166
MET A 170
THR A 171
LEU A 174
None
0.38A 3ag2J-4zi6A:
undetectable
3ag2J-4zi6A:
9.28
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.
5a22 VESICULAR STOMATITIS
VIRUS L POLYMERASE


(Vesicular
stomatitis
virus)
PF00946
(Mononeg_RNA_pol)
PF14314
(Methyltrans_Mon)
PF14318
(Mononeg_mRNAcap)
4 ARG A1215
MET A1198
THR A1199
LEU A1201
None
1.34A 3ag2J-5a22A:
undetectable
3ag2J-5a22A:
2.90
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.
5a96 POLYHEDRIN

(Cypovirus 14)
PF17515
(CPV_Polyhedrin)
4 ARG A 168
MET A 173
THR A 172
LEU A  61
GTP  A1250 (-4.3A)
None
None
None
1.22A 3ag2J-5a96A:
undetectable
3ag2J-5a96A:
12.55
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.
5aov GLYOXYLATE REDUCTASE

(Pyrococcus
furiosus)
PF00389
(2-Hacid_dh)
PF02826
(2-Hacid_dh_C)
4 TYR A 220
MET A 219
THR A 218
LEU A 214
EDO  A1351 (-3.4A)
1PE  A1349 (-4.2A)
NAP  A1335 (-4.2A)
1PE  A1345 (-4.5A)
1.33A 3ag2J-5aovA:
undetectable
3ag2J-5aovA:
13.44
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.
5b0n E3 UBIQUITIN-PROTEIN
LIGASE IPAH9.8


(Shigella
flexneri)
PF12468
(TTSSLRR)
4 ARG A 163
MET A 142
THR A 141
LEU A 122
None
1.30A 3ag2J-5b0nA:
undetectable
3ag2J-5b0nA:
11.16
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.
5cws NUCLEOPORIN NSP1

(Chaetomium
thermophilum)
PF05064
(Nsp1_C)
4 TYR C 544
ARG C 543
THR C 538
LEU C 537
None
1.25A 3ag2J-5cwsC:
2.1
3ag2J-5cwsC:
14.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5dne L-ASPARAGINASE

(Cavia porcellus)
PF00710
(Asparaginase)
4 ARG A 182
MET A 358
THR A 359
LEU A 360
None
1.30A 3ag2J-5dneA:
undetectable
3ag2J-5dneA:
6.63
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.
5dum 65C6 HEAVY CHAIN

(Homo sapiens)
PF07654
(C1-set)
PF07686
(V-set)
4 TYR H  95
MET H  93
THR H 121
LEU H 122
None
1.40A 3ag2J-5dumH:
undetectable
3ag2J-5dumH:
11.86
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.
5ezr CGMP-DEPENDENT
PROTEIN KINASE,
PUTATIVE


(Plasmodium
vivax)
PF00027
(cNMP_binding)
PF00069
(Pkinase)
4 ARG A 276
MET A 279
THR A 280
LEU A 283
None
1.07A 3ag2J-5ezrA:
undetectable
3ag2J-5ezrA:
6.28
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.
5f96 HEAVY CHAIN OF
ANTIBODY CH235.12


(Homo sapiens)
PF07654
(C1-set)
PF07686
(V-set)
4 ARG H  82
MET H  18
THR H  19
LEU H  20
None
1.33A 3ag2J-5f96H:
undetectable
3ag2J-5f96H:
13.36
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.
5fdn PHOSPHOENOLPYRUVATE
CARBOXYLASE 3


(Arabidopsis
thaliana)
PF00311
(PEPcase)
4 ARG A 666
MET A 634
THR A 633
LEU A 632
None
1.19A 3ag2J-5fdnA:
undetectable
3ag2J-5fdnA:
4.26
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.
5g56 CARBOHYDRATE BINDING
FAMILY 6


(Ruminiclostridium
thermocellum)
PF00150
(Cellulase)
PF03422
(CBM_6)
4 TYR A  75
ARG A 121
THR A 122
LEU A 127
None
1.40A 3ag2J-5g56A:
undetectable
3ag2J-5g56A:
4.71
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.
5gnc AVH146

(Phytophthora
sojae)
no annotation 4 TYR A 232
MET A 228
THR A 227
LEU A 224
None
0.94A 3ag2J-5gncA:
undetectable
3ag2J-5gncA:
7.63
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.
5iig VACUOLAR TRANSPORTER
CHAPERONE 4


(Saccharomyces
cerevisiae)
PF03105
(SPX)
PF09359
(VTC)
4 ARG A 356
MET A 382
THR A 381
LEU A 380
None
0.93A 3ag2J-5iigA:
undetectable
3ag2J-5iigA:
9.17
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.
5j1i PLECTIN

(Homo sapiens)
no annotation 4 TYR A1302
ARG A1240
THR A1148
LEU A1152
None
1.35A 3ag2J-5j1iA:
1.8
3ag2J-5j1iA:
10.57
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.
5lki TCDA1

(Photorhabdus
luminescens)
PF03538
(VRP1)
4 ARG A1602
MET A1596
THR A1585
LEU A1584
None
1.18A 3ag2J-5lkiA:
1.5
3ag2J-5lkiA:
2.12
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.
5mob SLPYL1_ABA

(Solanum
lycopersicum)
PF10604
(Polyketide_cyc2)
4 ARG A 109
MET A 110
THR A 111
LEU A 136
None
1.16A 3ag2J-5mobA:
undetectable
3ag2J-5mobA:
13.36
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.
5mwl INOSITOL-PENTAKISPHO
SPHATE 2-KINASE


(Mus musculus)
PF06090
(Ins_P5_2-kin)
4 TYR A 392
ARG A 393
MET A 396
THR A 397
None
1.01A 3ag2J-5mwlA:
undetectable
3ag2J-5mwlA:
8.96
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.
5nm7 PEPTIDOGLYCAN-BINDIN
G DOMAIN 1


(Burkholderia)
no annotation 4 TYR G 117
ARG G 119
MET G 122
LEU G 126
None
0.80A 3ag2J-5nm7G:
undetectable
3ag2J-5nm7G:
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.
5nn8 LYSOSOMAL
ALPHA-GLUCOSIDASE


(Homo sapiens)
no annotation 4 TYR A 685
MET A 391
THR A 392
LEU A 398
NAG  A1007 (-4.2A)
None
None
None
1.15A 3ag2J-5nn8A:
undetectable
3ag2J-5nn8A:
5.16
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.
5non S-NORCOCLAURINE
SYNTHASE


(Thalictrum
flavum)
PF00407
(Bet_v_1)
4 TYR A 108
MET A  97
THR A  98
LEU A  83
None
93H  A 501 (-4.2A)
None
None
1.33A 3ag2J-5nonA:
undetectable
3ag2J-5nonA:
18.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5o3w PEPTIDE CYCLASE 1

(Gypsophila
vaccaria)
no annotation 4 TYR A 642
MET A 668
THR A 667
LEU A 664
None
1.33A 3ag2J-5o3wA:
undetectable
3ag2J-5o3wA:
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.
5o5a PEREGRIN

(Homo sapiens)
no annotation 4 TYR A 687
ARG A 686
MET A 678
THR A 677
None
1.05A 3ag2J-5o5aA:
undetectable
3ag2J-5o5aA:
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.
5o6v FAB 19/1786 - HEAVY
CHAIN


(Mus musculus)
no annotation 4 TYR H  95
MET H  93
THR H 114
LEU H 115
None
1.42A 3ag2J-5o6vH:
undetectable
3ag2J-5o6vH:
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.
5tzn KILLER CELL
LECTIN-LIKE RECEPTOR
SUBFAMILY B MEMBER
1B ALLELE B
GLYCOPROTEIN FAMILY
PROTEIN M12


(Mus musculus;
Murid
betaherpesvirus
1)
PF00059
(Lectin_C)
PF12216
(m04gp34like)
4 TYR A 158
ARG F  49
MET A 163
THR A 161
None
1.36A 3ag2J-5tznA:
undetectable
3ag2J-5tznA:
18.25
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.
5u0u DH270.1 SINGLE-CHAIN
VARIABLE FRAGMENT


(Homo sapiens)
no annotation 4 TYR G  95
MET G  93
THR G 121
LEU G 122
None
1.32A 3ag2J-5u0uG:
undetectable
3ag2J-5u0uG:
11.58
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.
5uc2 DOMAIN OF UNKNOWN
FUNCTION DUF1849


(Brucella
abortus)
PF08904
(DUF1849)
4 ARG A 236
MET A 252
THR A 251
LEU A 250
None
1.30A 3ag2J-5uc2A:
undetectable
3ag2J-5uc2A:
14.29
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.
5uc2 DOMAIN OF UNKNOWN
FUNCTION DUF1849


(Brucella
abortus)
PF08904
(DUF1849)
4 TYR A 235
MET A 252
THR A 251
LEU A 250
None
1.25A 3ag2J-5uc2A:
undetectable
3ag2J-5uc2A:
14.29
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.
5v6b PDZ
DOMAIN-CONTAINING
PROTEIN GIPC1


(Mus musculus)
PF00595
(PDZ)
4 ARG A 307
MET A 287
THR A 286
LEU A 283
None
1.07A 3ag2J-5v6bA:
undetectable
3ag2J-5v6bA:
14.88
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.
5v6e PDZ
DOMAIN-CONTAINING
PROTEIN GIPC1


(Mus musculus)
no annotation 4 ARG A 307
MET A 287
THR A 286
LEU A 283
None
1.37A 3ag2J-5v6eA:
undetectable
3ag2J-5v6eA:
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.
5vhv ALKYLPURINE DNA
GLYCOSYLASE ALKC


(Pseudomonas
fluorescens)
no annotation 4 TYR A  69
ARG A 106
THR A  74
LEU A  76
None
1.39A 3ag2J-5vhvA:
undetectable
3ag2J-5vhvA:
9.70
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.
5vxz GROWTH
ARREST-SPECIFIC
PROTEIN 6


(Homo sapiens)
PF00054
(Laminin_G_1)
PF02210
(Laminin_G_2)
4 TYR A 480
MET A 644
THR A 645
LEU A 646
None
1.34A 3ag2J-5vxzA:
undetectable
3ag2J-5vxzA:
8.21
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.
5xk8 UNDECAPRENYL
DIPHOSPHATE SYNTHASE


(Streptomyces
sp. CNH189)
no annotation 4 TYR A  26
MET A  29
THR A  30
LEU A  33
None
1.04A 3ag2J-5xk8A:
undetectable
3ag2J-5xk8A:
undetectable