SIMILAR PATTERNS OF AMINO ACIDS FOR 5B1A_J_CHDJ102

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.
1flo FLP RECOMBINASE

(Saccharomyces
cerevisiae) 		PF03930
(Flp_N)
PF05202
(Flp_C) 		4 ILE A 350
MET A 311
THR A 312
LEU A 315
 None
 0.78A 5b1aA-1floA:
0.0
5b1aJ-1floA:
0.0		 5b1aA-1floA:
21.78
5b1aJ-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.
1har HIV-1 REVERSE
TRANSCRIPTASE
(FINGERS AND PALM
SUBDOMAINS)

(Human
immunodeficiency
virus 1) 		PF00078
(RVT_1) 		4 LEU A 109
MET A 164
THR A 165
LEU A 168
 None
 0.70A 5b1aA-1harA:
undetectable
5b1aJ-1harA:
0.1		 5b1aA-1harA:
18.00
5b1aJ-1harA:
13.37
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.
1idj PECTIN LYASE A

(Aspergillus
niger) 		PF00544
(Pec_lyase_C) 		4 ILE A 337
LEU A 306
ARG A 188
LEU A 245
 None
 0.97A 5b1aA-1idjA:
undetectable
5b1aJ-1idjA:
0.0		 5b1aA-1idjA:
21.59
5b1aJ-1idjA:
11.93
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.
1iv8 MALTOOLIGOSYL
TREHALOSE SYNTHASE

(Sulfolobus
acidocaldarius) 		PF00128
(Alpha-amylase)
PF09196
(DUF1953) 		4 ILE A 129
LEU A 181
TYR A 190
LEU A 104
 None
None
None
MLZ  A 105 ( 4.3A)
 0.92A 5b1aA-1iv8A:
0.0
5b1aJ-1iv8A:
0.0		 5b1aA-1iv8A:
20.68
5b1aJ-1iv8A:
5.63
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.
1jed SULFATE
ADENYLYLTRANSFERASE

(Saccharomyces
cerevisiae) 		PF01747
(ATP-sulfurylase)
PF14306
(PUA_2) 		5 ILE A  48
LEU A  49
ARG A  40
THR A  38
LEU A  37
 None
 1.13A 5b1aA-1jedA:
0.0
5b1aJ-1jedA:
0.0		 5b1aA-1jedA:
21.17
5b1aJ-1jedA:
8.97
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.
1jfi TRANSCRIPTION
REGULATOR NC2 ALPHA
CHAIN
TRANSCRIPTION
REGULATOR NC2 BETA
CHAIN

(Homo sapiens;
Homo sapiens) 		PF00808
(CBFD_NFYB_HMF)
PF00808
(CBFD_NFYB_HMF) 		4 ILE B 122
LEU B 126
THR A  67
LEU A  70
 None
 0.94A 5b1aA-1jfiB:
undetectable
5b1aJ-1jfiB:
1.6		 5b1aA-1jfiB:
14.49
5b1aJ-1jfiB:
12.85
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.
1k7s FERRICHROME-BINDING
PERIPLASMIC PROTEIN

(Escherichia
coli) 		PF01497
(Peripla_BP_2) 		4 ILE N 292
LEU N 288
THR N 180
LEU N 179
 None
 0.89A 5b1aA-1k7sN:
undetectable
5b1aJ-1k7sN:
undetectable		 5b1aA-1k7sN:
20.17
5b1aJ-1k7sN:
12.08
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.
1khc DNA CYTOSINE-5
METHYLTRANSFERASE
3B2

(Mus musculus) 		PF00855
(PWWP) 		4 TYR A 305
ARG A 306
MET A 309
LEU A 313
 None
 0.96A 5b1aA-1khcA:
undetectable
5b1aJ-1khcA:
undetectable		 5b1aA-1khcA:
13.81
5b1aJ-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.
1kt8 BRANCHED-CHAIN AMINO
ACID
AMINOTRANSFERASE,
MITOCHONDRIAL

(Homo sapiens) 		PF01063
(Aminotran_4) 		4 ILE A 332
MET A 293
THR A 292
LEU A 235
 None
 0.84A 5b1aA-1kt8A:
0.0
5b1aJ-1kt8A:
undetectable		 5b1aA-1kt8A:
22.71
5b1aJ-1kt8A:
12.03
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.
1kyw CAFFEIC ACID
3-O-METHYLTRANSFERAS
E

(Medicago sativa) 		PF00891
(Methyltransf_2)
PF08100
(Dimerisation) 		4 ILE A  62
LEU A  77
THR A  91
LEU A  90
 None
 0.96A 5b1aA-1kywA:
0.3
5b1aJ-1kywA:
undetectable		 5b1aA-1kywA:
22.20
5b1aJ-1kywA:
10.16
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.
1lc7 L-THREONINE-O-3-PHOS
PHATE DECARBOXYLASE

(Salmonella
enterica) 		PF00155
(Aminotran_1_2) 		4 LEU A 182
ARG A 100
THR A 144
LEU A 143
 None
 0.80A 5b1aA-1lc7A:
0.0
5b1aJ-1lc7A:
undetectable		 5b1aA-1lc7A:
21.47
5b1aJ-1lc7A:
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.
1mc8 FLAP ENDONUCLEASE-1

(Pyrococcus
horikoshii) 		PF00752
(XPG_N)
PF00867
(XPG_I) 		4 ILE A   5
LEU A   8
ARG A 223
THR A 222
 None
 0.85A 5b1aA-1mc8A:
0.0
5b1aJ-1mc8A:
undetectable		 5b1aA-1mc8A:
20.59
5b1aJ-1mc8A:
10.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ml4 ASPARTATE
TRANSCARBAMOYLASE

(Pyrococcus
abyssi) 		PF00185
(OTCace)
PF02729
(OTCace_N) 		4 ILE A 104
LEU A  50
ARG A 115
LEU A  90
 None
 0.86A 5b1aA-1ml4A:
0.0
5b1aJ-1ml4A:
undetectable		 5b1aA-1ml4A:
21.77
5b1aJ-1ml4A:
13.01
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.
1ozn RETICULON 4 RECEPTOR

(Homo sapiens) 		PF13855
(LRR_8) 		4 LEU A 112
ARG A  61
THR A  84
LEU A 107
 None
 0.77A 5b1aA-1oznA:
undetectable
5b1aJ-1oznA:
undetectable		 5b1aA-1oznA:
19.64
5b1aJ-1oznA:
11.68
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.
1p9d UV EXCISION REPAIR
PROTEIN RAD23
HOMOLOG A

(Homo sapiens) 		PF00240
(ubiquitin) 		4 ILE U   5
LEU U  28
ARG U  65
LEU U  55
 None
 0.96A 5b1aA-1p9dU:
undetectable
5b1aJ-1p9dU:
undetectable		 5b1aA-1p9dU:
8.56
5b1aJ-1p9dU:
19.23
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.
1pm2 RIBONUCLEOSIDE-DIPHO
SPHATE REDUCTASE 1
BETA CHAIN

(Escherichia
coli) 		PF00268
(Ribonuc_red_sm) 		5 ILE A 335
LEU A 339
TYR A 310
ARG A 328
THR A 312
 None
None
None
HG  A 614 ( 4.9A)
None
 1.46A 5b1aA-1pm2A:
0.8
5b1aJ-1pm2A:
undetectable		 5b1aA-1pm2A:
19.19
5b1aJ-1pm2A:
11.21
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.
1qf7 PROTEIN (CATALASE
HPII)

(Escherichia
coli) 		PF00199
(Catalase)
PF06628
(Catalase-rel) 		4 ILE A 666
MET A 736
THR A 734
LEU A 733
 None
 0.93A 5b1aA-1qf7A:
undetectable
5b1aJ-1qf7A:
undetectable		 5b1aA-1qf7A:
21.37
5b1aJ-1qf7A:
6.27
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.
1qst TGCN5 HISTONE ACETYL
TRANSFERASE

(Tetrahymena
thermophila) 		PF00583
(Acetyltransf_1) 		4 ILE A  72
LEU A  69
ARG A 135
LEU A 141
 None
 0.96A 5b1aA-1qstA:
undetectable
5b1aJ-1qstA:
undetectable		 5b1aA-1qstA:
13.35
5b1aJ-1qstA:
15.19
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.
1r6x ATP:SULFATE
ADENYLYLTRANSFERASE

(Saccharomyces
cerevisiae) 		PF01747
(ATP-sulfurylase)
PF14306
(PUA_2) 		5 ILE A  48
LEU A  49
ARG A  40
THR A  38
LEU A  37
 None
 1.11A 5b1aA-1r6xA:
undetectable
5b1aJ-1r6xA:
undetectable		 5b1aA-1r6xA:
21.48
5b1aJ-1r6xA:
11.44
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.
1u00 CHAPERONE PROTEIN
HSCA

(Escherichia
coli) 		PF00012
(HSP70) 		4 ILE A 409
LEU A 396
ARG A 470
THR A 484
 None
 0.82A 5b1aA-1u00A:
2.4
5b1aJ-1u00A:
undetectable		 5b1aA-1u00A:
17.75
5b1aJ-1u00A:
13.11
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.
1u1h 5-METHYLTETRAHYDROPT
EROYLTRIGLUTAMATE--H
OMOCYSTEINE
METHYLTRANSFERASE

(Arabidopsis
thaliana) 		PF01717
(Meth_synt_2)
PF08267
(Meth_synt_1) 		4 LEU A 239
TYR A 226
THR A 254
LEU A 255
 None
 0.98A 5b1aA-1u1hA:
undetectable
5b1aJ-1u1hA:
undetectable		 5b1aA-1u1hA:
21.32
5b1aJ-1u1hA:
4.69
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.
1v9v KIAA0561 PROTEIN

(Homo sapiens) 		PF08926
(DUF1908) 		4 ILE A 102
LEU A  99
THR A  23
LEU A  22
 None
 0.95A 5b1aA-1v9vA:
2.0
5b1aJ-1v9vA:
undetectable		 5b1aA-1v9vA:
12.30
5b1aJ-1v9vA:
15.52
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.
1ysp TRANSCRIPTIONAL
REGULATOR KDGR

(Escherichia
coli) 		PF01614
(IclR) 		4 ILE A  35
LEU A  24
ARG A  53
LEU A  65
 None
 0.90A 5b1aA-1yspA:
undetectable
5b1aJ-1yspA:
undetectable		 5b1aA-1yspA:
15.37
5b1aJ-1yspA:
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.
1yw6 SUCCINYLGLUTAMATE
DESUCCINYLASE

(Escherichia
coli) 		PF04952
(AstE_AspA) 		4 ILE A  48
LEU A 144
THR A 148
LEU A 211
 None
 0.94A 5b1aA-1yw6A:
undetectable
5b1aJ-1yw6A:
undetectable		 5b1aA-1yw6A:
20.62
5b1aJ-1yw6A:
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.
1yx1 HYPOTHETICAL PROTEIN
PA2260

(Pseudomonas
aeruginosa) 		PF01261
(AP_endonuc_2) 		4 LEU A  10
ARG A  90
THR A  51
LEU A  54
 None
 0.92A 5b1aA-1yx1A:
undetectable
5b1aJ-1yx1A:
undetectable		 5b1aA-1yx1A:
18.52
5b1aJ-1yx1A:
13.08
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.
1zv4 REGULATOR OF
G-PROTEIN SIGNALING
17

(Homo sapiens) 		PF00615
(RGS) 		4 ILE X 178
LEU X 181
ARG X  95
LEU X 102
 None
 0.94A 5b1aA-1zv4X:
undetectable
5b1aJ-1zv4X:
undetectable		 5b1aA-1zv4X:
13.67
5b1aJ-1zv4X:
18.79
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.
2b9b FUSION GLYCOPROTEIN
F0

(Mammalian
rubulavirus 5) 		PF00523
(Fusion_gly) 		4 LEU A 227
TYR A  72
THR A  77
LEU A  80
 None
 0.75A 5b1aA-2b9bA:
undetectable
5b1aJ-2b9bA:
2.5		 5b1aA-2b9bA:
21.63
5b1aJ-2b9bA:
9.53
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.
2be7 ASPARTATE
CARBAMOYLTRANSFERASE
CATALYTIC CHAIN
ASPARTATE
CARBAMOYLTRANSFERASE
REGULATORY CHAIN

(Moritella
profunda;
Moritella
profunda) 		PF00185
(OTCace)
PF02729
(OTCace_N)
PF01948
(PyrI)
PF02748
(PyrI_C) 		4 ILE D 114
LEU A 115
ARG A 106
MET A 105
 None
 0.78A 5b1aA-2be7D:
undetectable
5b1aJ-2be7D:
undetectable		 5b1aA-2be7D:
17.43
5b1aJ-2be7D:
16.28
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.
2buc DIPEPTIDYL PEPTIDASE
IV

(Sus scrofa) 		PF00326
(Peptidase_S9)
PF00930
(DPPIV_N) 		4 ILE A 384
ARG A 433
THR A 411
LEU A 410
 None
 0.96A 5b1aA-2bucA:
undetectable
5b1aJ-2bucA:
undetectable		 5b1aA-2bucA:
19.97
5b1aJ-2bucA:
7.59
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.
2bwg GMP REDUCTASE I

(Homo sapiens) 		PF00478
(IMPDH) 		4 ILE A 154
MET A 113
THR A 114
LEU A 117
 None
 0.91A 5b1aA-2bwgA:
undetectable
5b1aJ-2bwgA:
undetectable		 5b1aA-2bwgA:
21.02
5b1aJ-2bwgA:
10.16
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.
2c4m GLYCOGEN
PHOSPHORYLASE

(Corynebacterium
callunae) 		PF00343
(Phosphorylase) 		4 ILE A 491
LEU A 488
THR A 457
LEU A 456
 None
 0.89A 5b1aA-2c4mA:
2.5
5b1aJ-2c4mA:
undetectable		 5b1aA-2c4mA:
19.75
5b1aJ-2c4mA:
6.41
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.
2e5n RNA POLYMERASE II
ELONGATION FACTOR
ELL2

(Homo sapiens) 		PF10390
(ELL) 		4 ILE A  19
LEU A  68
TYR A  83
LEU A  95
 None
 0.96A 5b1aA-2e5nA:
undetectable
5b1aJ-2e5nA:
undetectable		 5b1aA-2e5nA:
12.01
5b1aJ-2e5nA:
21.43
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.
2eg5 XANTHOSINE
METHYLTRANSFERASE

(Coffea
canephora) 		PF03492
(Methyltransf_7) 		4 ILE A 287
LEU A 363
THR A 292
LEU A 359
 None
 0.91A 5b1aA-2eg5A:
undetectable
5b1aJ-2eg5A:
undetectable		 5b1aA-2eg5A:
22.14
5b1aJ-2eg5A:
9.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2fbi PROBABLE
TRANSCRIPTIONAL
REGULATOR

(Pseudomonas
aeruginosa) 		PF01047
(MarR) 		4 ARG A  62
MET A  65
THR A  66
LEU A  69
 None
 0.85A 5b1aA-2fbiA:
undetectable
5b1aJ-2fbiA:
undetectable		 5b1aA-2fbiA:
13.47
5b1aJ-2fbiA:
14.08
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.
2fge ZINC METALLOPROTEASE
(INSULINASE FAMILY)

(Arabidopsis
thaliana) 		PF00675
(Peptidase_M16)
PF05193
(Peptidase_M16_C)
PF08367
(M16C_assoc) 		5 ILE A 618
LEU A 661
ARG A 676
THR A 610
LEU A 609
 None
 1.43A 5b1aA-2fgeA:
1.4
5b1aJ-2fgeA:
undetectable		 5b1aA-2fgeA:
18.66
5b1aJ-2fgeA:
6.46
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.
2fzv PUTATIVE ARSENICAL
RESISTANCE PROTEIN

(Shigella
flexneri) 		PF03358
(FMN_red) 		4 ILE A 122
ARG A 163
MET A 167
LEU A 140
 None
 0.93A 5b1aA-2fzvA:
undetectable
5b1aJ-2fzvA:
undetectable		 5b1aA-2fzvA:
19.96
5b1aJ-2fzvA:
10.18
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.
2hnz REVERSE
TRANSCRIPTASE/RIBONU
CLEASE H

(Human
immunodeficiency
virus 1) 		PF00075
(RNase_H)
PF00078
(RVT_1)
PF06815
(RVT_connect)
PF06817
(RVT_thumb) 		4 LEU A 109
MET A 164
THR A 165
LEU A 168
 None
 0.75A 5b1aA-2hnzA:
2.3
5b1aJ-2hnzA:
undetectable		 5b1aA-2hnzA:
19.77
5b1aJ-2hnzA:
6.86
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.
2ihy ABC TRANSPORTER,
ATP-BINDING PROTEIN

(Staphylococcus
aureus) 		PF00005
(ABC_tran) 		4 ILE A 184
LEU A 188
ARG A 178
LEU A 166
 None
 0.91A 5b1aA-2ihyA:
undetectable
5b1aJ-2ihyA:
undetectable		 5b1aA-2ihyA:
19.92
5b1aJ-2ihyA:
11.03
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.
2iy8 PROTEIN PM0188

(Pasteurella
multocida) 		PF11477
(PM0188) 		4 ILE A 117
LEU A 121
ARG A 186
LEU A 168
 None
 0.95A 5b1aA-2iy8A:
undetectable
5b1aJ-2iy8A:
undetectable		 5b1aA-2iy8A:
22.50
5b1aJ-2iy8A:
9.78
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.
2j3z C2 TOXIN COMPONENT I

(Clostridium
botulinum) 		PF03496
(ADPrib_exo_Tox) 		4 LEU A  89
ARG A  28
THR A  31
LEU A  33
 None
 0.96A 5b1aA-2j3zA:
undetectable
5b1aJ-2j3zA:
undetectable		 5b1aA-2j3zA:
19.36
5b1aJ-2j3zA:
12.62
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.
2jnu REGULATOR OF
G-PROTEIN SIGNALING
14

(Homo sapiens) 		PF00615
(RGS) 		4 ILE A 109
LEU A 112
THR A  29
LEU A  32
 None
 0.92A 5b1aA-2jnuA:
undetectable
5b1aJ-2jnuA:
undetectable		 5b1aA-2jnuA:
16.82
5b1aJ-2jnuA:
14.94
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.
2kbq HARMONIN

(Homo sapiens) 		no annotation 4 ILE A  50
LEU A  58
TYR A  74
LEU A  30
 None
 0.80A 5b1aA-2kbqA:
undetectable
5b1aJ-2kbqA:
undetectable		 5b1aA-2kbqA:
8.84
5b1aJ-2kbqA:
23.68
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.
2lf8 TRANSCRIPTION FACTOR
ETV6

(Mus musculus) 		PF00178
(Ets) 		4 ILE A 366
LEU A 372
ARG A 395
LEU A 337
 None
 0.87A 5b1aA-2lf8A:
undetectable
5b1aJ-2lf8A:
undetectable		 5b1aA-2lf8A:
12.14
5b1aJ-2lf8A:
19.69
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.
2m6k FERRIENTEROBACTIN-BI
NDING PERIPLASMIC
PROTEIN

(Escherichia
coli) 		PF01497
(Peripla_BP_2) 		4 ILE A 142
LEU A 117
THR A  38
LEU A  39
 None
 0.96A 5b1aA-2m6kA:
undetectable
5b1aJ-2m6kA:
undetectable		 5b1aA-2m6kA:
18.83
5b1aJ-2m6kA:
10.58
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.
2ozg GCN5-RELATED
N-ACETYLTRANSFERASE

(Trichormus
variabilis) 		PF13527
(Acetyltransf_9)
PF13530
(SCP2_2) 		4 ILE A  25
LEU A  22
ARG A  54
LEU A  99
 None
 0.90A 5b1aA-2ozgA:
undetectable
5b1aJ-2ozgA:
undetectable		 5b1aA-2ozgA:
21.72
5b1aJ-2ozgA:
9.97
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.
2p0d RHO
GTPASE-ACTIVATING
PROTEIN 9

(Homo sapiens) 		PF00169
(PH) 		4 ILE A 405
LEU A 390
THR A 353
LEU A 352
 None
 0.74A 5b1aA-2p0dA:
undetectable
5b1aJ-2p0dA:
undetectable		 5b1aA-2p0dA:
12.67
5b1aJ-2p0dA:
17.65
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.
2p3g MAP KINASE-ACTIVATED
PROTEIN KINASE 2

(Homo sapiens) 		PF00069
(Pkinase) 		4 ILE X 252
MET X 356
THR X 357
LEU X 360
 None
 0.77A 5b1aA-2p3gX:
undetectable
5b1aJ-2p3gX:
undetectable		 5b1aA-2p3gX:
19.81
5b1aJ-2p3gX:
13.79
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.
2qjw UNCHARACTERIZED
PROTEIN XCC1541

(Xanthomonas
campestris) 		no annotation 4 ILE A 121
LEU A  99
THR A 106
LEU A 114
 None
 0.89A 5b1aA-2qjwA:
undetectable
5b1aJ-2qjwA:
undetectable		 5b1aA-2qjwA:
16.20
5b1aJ-2qjwA:
16.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2rdl CHYMASE 2

(Mesocricetus
auratus) 		PF00089
(Trypsin) 		4 ILE A 231
ARG A  48
THR A 120
LEU A 121
 None
 0.94A 5b1aA-2rdlA:
undetectable
5b1aJ-2rdlA:
undetectable		 5b1aA-2rdlA:
17.87
5b1aJ-2rdlA:
13.57
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.
2v1w PDZ AND LIM DOMAIN
PROTEIN 4

(Homo sapiens) 		PF00595
(PDZ) 		4 ILE A  69
LEU A  76
ARG A  16
LEU A  43
 None
 0.95A 5b1aA-2v1wA:
undetectable
5b1aJ-2v1wA:
undetectable		 5b1aA-2v1wA:
10.44
5b1aJ-2v1wA:
14.77
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.
2y24 XYLANASE

(Dickeya
chrysanthemi) 		PF02055
(Glyco_hydro_30)
PF17189
(Glyco_hydro_30C) 		4 ILE A  75
LEU A  77
THR A  60
LEU A  59
 None
 0.72A 5b1aA-2y24A:
undetectable
5b1aJ-2y24A:
undetectable		 5b1aA-2y24A:
22.63
5b1aJ-2y24A:
8.72
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.
2y69 CYTOCHROME C OXIDASE
POLYPEPTIDE 7A1

(Bos taurus) 		PF02238
(COX7a) 		4 TYR J  32
MET J  36
THR J  37
LEU J  40
 None
 0.00A 5b1aA-2y69J:
undetectable
5b1aJ-2y69J:
7.9		 5b1aA-2y69J:
10.31
5b1aJ-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.
2yvt HYPOTHETICAL PROTEIN
AQ_1956

(Aquifex
aeolicus) 		PF14582
(Metallophos_3) 		4 ILE A 164
LEU A 165
THR A 144
LEU A 143
 None
 0.91A 5b1aA-2yvtA:
undetectable
5b1aJ-2yvtA:
undetectable		 5b1aA-2yvtA:
18.01
5b1aJ-2yvtA:
13.11
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.
2z0f PUTATIVE
PHOSPHOGLUCOMUTASE

(Thermus
thermophilus) 		PF00408
(PGM_PMM_IV)
PF02878
(PGM_PMM_I)
PF02879
(PGM_PMM_II)
PF02880
(PGM_PMM_III) 		4 ILE A  48
ARG A  32
THR A 128
LEU A 127
 None
 0.96A 5b1aA-2z0fA:
undetectable
5b1aJ-2z0fA:
undetectable		 5b1aA-2z0fA:
24.11
5b1aJ-2z0fA:
7.28
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.
2ziu MUS81 PROTEIN

(Danio rerio) 		PF02732
(ERCC4) 		4 TYR A 471
MET A 475
THR A 476
LEU A 479
 None
 0.84A 5b1aA-2ziuA:
undetectable
5b1aJ-2ziuA:
undetectable		 5b1aA-2ziuA:
18.55
5b1aJ-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.
2zsg AMINOPEPTIDASE P,
PUTATIVE

(Thermotoga
maritima) 		PF00557
(Peptidase_M24)
PF01321
(Creatinase_N) 		5 ILE A 230
ARG A 151
MET A 177
THR A 176
LEU A 173
 None
 0.95A 5b1aA-2zsgA:
2.6
5b1aJ-2zsgA:
undetectable		 5b1aA-2zsgA:
20.79
5b1aJ-2zsgA:
10.49
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.
3b2d CD180 ANTIGEN

(Homo sapiens) 		PF00560
(LRR_1)
PF13855
(LRR_8) 		4 LEU A 503
ARG A 472
MET A 522
LEU A 519
 None
 0.90A 5b1aA-3b2dA:
undetectable
5b1aJ-3b2dA:
undetectable		 5b1aA-3b2dA:
20.65
5b1aJ-3b2dA:
7.13
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.
3bn1 PEROSAMINE
SYNTHETASE

(Caulobacter
vibrioides) 		PF01041
(DegT_DnrJ_EryC1) 		4 ILE A 312
TYR A 261
THR A 289
LEU A 346
 None
 0.95A 5b1aA-3bn1A:
undetectable
5b1aJ-3bn1A:
undetectable		 5b1aA-3bn1A:
21.12
5b1aJ-3bn1A:
11.24
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.
3bz6 UPF0502 PROTEIN
PSPTO_2686

(Pseudomonas
syringae group
genomosp. 3) 		PF04337
(DUF480) 		4 ILE A 172
LEU A  17
ARG A  25
LEU A  76
 None
 0.82A 5b1aA-3bz6A:
undetectable
5b1aJ-3bz6A:
undetectable		 5b1aA-3bz6A:
15.42
5b1aJ-3bz6A:
16.57
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.
3c9b VACUOLAR PROTEIN
SORTING-ASSOCIATED
PROTEIN 75

(Saccharomyces
cerevisiae) 		PF00956
(NAP) 		4 ILE A  80
LEU A  62
ARG A  73
LEU A 200
 None
 0.76A 5b1aA-3c9bA:
undetectable
5b1aJ-3c9bA:
undetectable		 5b1aA-3c9bA:
16.41
5b1aJ-3c9bA:
12.99
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.
3ced METHIONINE IMPORT
ATP-BINDING PROTEIN
METN 2

(Staphylococcus
aureus) 		PF09383
(NIL) 		4 ILE A 313
ARG A 267
MET A 335
LEU A 328
 None
 0.92A 5b1aA-3cedA:
undetectable
5b1aJ-3cedA:
undetectable		 5b1aA-3cedA:
11.49
5b1aJ-3cedA:
24.36
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.
3dka DINB-LIKE PROTEIN

(Bacillus
subtilis) 		PF05163
(DinB) 		4 ILE A 105
LEU A 120
THR A  97
LEU A  96
 None
 0.88A 5b1aA-3dkaA:
2.8
5b1aJ-3dkaA:
undetectable		 5b1aA-3dkaA:
13.42
5b1aJ-3dkaA:
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.
3dni DEOXYRIBONUCLEASE I

(Bos taurus) 		PF03372
(Exo_endo_phos) 		4 ILE A  37
LEU A  81
ARG A  31
LEU A  55
 None
 0.96A 5b1aA-3dniA:
undetectable
5b1aJ-3dniA:
undetectable		 5b1aA-3dniA:
17.90
5b1aJ-3dniA:
12.30
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.
3e4e CYTOCHROME P450 2E1

(Homo sapiens) 		PF00067
(p450) 		4 ILE A 172
LEU A 308
TYR A 485
LEU A 460
 None
 0.92A 5b1aA-3e4eA:
undetectable
5b1aJ-3e4eA:
undetectable		 5b1aA-3e4eA:
21.62
5b1aJ-3e4eA:
7.98
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.
3e7f 6-PHOSPHOGLUCONOLACT
ONASE

(Trypanosoma
brucei) 		PF01182
(Glucosamine_iso) 		4 ILE A 230
LEU A 231
THR A 219
LEU A 255
 None
 0.83A 5b1aA-3e7fA:
undetectable
5b1aJ-3e7fA:
undetectable		 5b1aA-3e7fA:
19.65
5b1aJ-3e7fA:
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.
3ezu GGDEF DOMAIN PROTEIN

(Geobacter
sulfurreducens) 		PF00990
(GGDEF) 		4 ILE A 246
ARG A 284
THR A 298
LEU A 220
 None
 0.94A 5b1aA-3ezuA:
1.8
5b1aJ-3ezuA:
undetectable		 5b1aA-3ezuA:
21.10
5b1aJ-3ezuA:
10.53
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.
3ezx MONOMETHYLAMINE
CORRINOID PROTEIN 1

(Methanosarcina
barkeri) 		PF02310
(B12-binding)
PF02607
(B12-binding_2) 		4 ILE A  40
LEU A  37
ARG A 111
THR A 114
 None
 0.88A 5b1aA-3ezxA:
undetectable
5b1aJ-3ezxA:
undetectable		 5b1aA-3ezxA:
18.16
5b1aJ-3ezxA:
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.
3fss HISTONE CHAPERONE
RTT106

(Saccharomyces
cerevisiae) 		PF08512
(Rtt106) 		4 ILE A 200
MET A 158
THR A 159
LEU A 160
 None
 0.94A 5b1aA-3fssA:
undetectable
5b1aJ-3fssA:
undetectable		 5b1aA-3fssA:
19.04
5b1aJ-3fssA:
13.92
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.
3gju PUTATIVE
AMINOTRANSFERASE

(Mesorhizobium
japonicum) 		PF00202
(Aminotran_3) 		4 ILE A 131
MET A 159
THR A 160
LEU A 163
 None
 0.87A 5b1aA-3gjuA:
undetectable
5b1aJ-3gjuA:
undetectable		 5b1aA-3gjuA:
22.26
5b1aJ-3gjuA:
9.55
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.
3gmf PROTEIN-DISULFIDE
ISOMERASE

(Novosphingobium
aromaticivorans) 		PF13462
(Thioredoxin_4) 		4 ARG A 157
MET A 106
THR A 107
LEU A 110
 None
 0.92A 5b1aA-3gmfA:
undetectable
5b1aJ-3gmfA:
undetectable		 5b1aA-3gmfA:
16.83
5b1aJ-3gmfA:
12.62
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.
3h5t TRANSCRIPTIONAL
REGULATOR, LACI
FAMILY

(Corynebacterium
glutamicum) 		PF00356
(LacI)
PF13377
(Peripla_BP_3) 		4 ILE A 147
LEU A 152
THR A 331
LEU A 332
 None
 0.75A 5b1aA-3h5tA:
undetectable
5b1aJ-3h5tA:
undetectable		 5b1aA-3h5tA:
21.02
5b1aJ-3h5tA:
9.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3hve GIGAXONIN

(Homo sapiens) 		PF00651
(BTB)
PF07707
(BACK) 		4 ILE A  55
LEU A  48
THR A 115
LEU A 114
 None
 0.95A 5b1aA-3hveA:
2.5
5b1aJ-3hveA:
undetectable		 5b1aA-3hveA:
17.61
5b1aJ-3hveA:
12.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3jb9 PRE-MRNA-SPLICING
FACTOR CWF11

(Schizosaccharomyces
pombe) 		PF13087
(AAA_12)
PF16399
(Aquarius_N) 		4 ILE X 989
MET X 745
THR X 744
LEU X 743
 None
 0.92A 5b1aA-3jb9X:
undetectable
5b1aJ-3jb9X:
undetectable		 5b1aA-3jb9X:
16.83
5b1aJ-3jb9X:
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.
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
 0.77A 5b1aA-3k13A:
undetectable
5b1aJ-3k13A:
undetectable		 5b1aA-3k13A:
20.20
5b1aJ-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.
3k1r HARMONIN

(Homo sapiens) 		PF00595
(PDZ) 		4 ILE A  50
LEU A  58
TYR A  74
LEU A  30
 None
 0.86A 5b1aA-3k1rA:
undetectable
5b1aJ-3k1rA:
undetectable		 5b1aA-3k1rA:
14.45
5b1aJ-3k1rA:
16.15
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.
3kfu ASPARTYL/GLUTAMYL-TR
NA(ASN/GLN)
AMIDOTRANSFERASE
SUBUNIT B

(Thermus
thermophilus) 		PF02637
(GatB_Yqey)
PF02934
(GatB_N) 		4 ILE F 166
LEU F 163
ARG F 111
LEU F 153
 None
 0.79A 5b1aA-3kfuF:
undetectable
5b1aJ-3kfuF:
undetectable		 5b1aA-3kfuF:
18.69
5b1aJ-3kfuF:
10.22
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.
3kl7 PUTATIVE
METAL-DEPENDENT
HYDROLASE

(Parabacteroides
distasonis) 		PF13483
(Lactamase_B_3) 		4 ILE A 101
MET A 128
THR A 157
LEU A 156
 None
None
GOL  A 306 (-4.7A)
None
 0.89A 5b1aA-3kl7A:
undetectable
5b1aJ-3kl7A:
undetectable		 5b1aA-3kl7A:
16.47
5b1aJ-3kl7A:
12.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3kyj CHEY6 PROTEIN

(Rhodobacter
sphaeroides) 		PF00072
(Response_reg) 		4 ILE B   7
MET B 128
THR B 127
LEU B 124
 None
 0.92A 5b1aA-3kyjB:
undetectable
5b1aJ-3kyjB:
undetectable		 5b1aA-3kyjB:
15.09
5b1aJ-3kyjB:
18.46
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.
3lax PHENYLACETATE-COENZY
ME A LIGASE

(Bacteroides
vulgatus) 		PF14535
(AMP-binding_C_2) 		4 ILE A 358
ARG A 406
THR A 394
LEU A 397
 None
 0.89A 5b1aA-3laxA:
undetectable
5b1aJ-3laxA:
undetectable		 5b1aA-3laxA:
11.47
5b1aJ-3laxA:
19.15
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.
3mmn HISTIDINE KINASE
HOMOLOG

(Arabidopsis
thaliana) 		PF00072
(Response_reg) 		4 LEU A1103
ARG A 998
THR A1002
LEU A1005
 None
 0.97A 5b1aA-3mmnA:
undetectable
5b1aJ-3mmnA:
undetectable		 5b1aA-3mmnA:
15.61
5b1aJ-3mmnA:
12.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3o4z TELOMERE LENGTH
REGULATION PROTEIN
TEL2

(Saccharomyces
cerevisiae) 		PF10193
(Telomere_reg-2) 		4 ILE A 225
LEU A 222
ARG A 243
LEU A 246
 None
 0.91A 5b1aA-3o4zA:
undetectable
5b1aJ-3o4zA:
undetectable		 5b1aA-3o4zA:
21.65
5b1aJ-3o4zA:
6.59
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.
3o6o HEAT SHOCK PROTEIN
83

(Trypanosoma
brucei) 		PF00183
(HSP90)
PF02518
(HATPase_c) 		4 ILE A 192
ARG A  64
THR A  75
LEU A  74
 None
 0.96A 5b1aA-3o6oA:
undetectable
5b1aJ-3o6oA:
undetectable		 5b1aA-3o6oA:
17.96
5b1aJ-3o6oA:
13.08
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.
3p8c NCK-ASSOCIATED
PROTEIN 1

(Homo sapiens) 		PF09735
(Nckap1) 		4 LEU B 682
ARG B 705
THR B 709
LEU B 712
 None
 0.81A 5b1aA-3p8cB:
1.5
5b1aJ-3p8cB:
undetectable		 5b1aA-3p8cB:
18.35
5b1aJ-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.
3pf2 CELL WALL SURFACE
ANCHOR FAMILY
PROTEIN

(Streptococcus
agalactiae) 		PF16569
(GramPos_pilinBB)
PF16570
(GramPos_pilinD3) 		4 ILE A 236
LEU A 240
THR A 270
LEU A 271
 None
 0.77A 5b1aA-3pf2A:
undetectable
5b1aJ-3pf2A:
undetectable		 5b1aA-3pf2A:
18.65
5b1aJ-3pf2A:
12.09
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.
3rr1 PUTATIVE
D-GALACTONATE
DEHYDRATASE

(Ralstonia
pickettii) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		4 ILE A  93
LEU A  90
THR A   7
LEU A   6
 None
 0.69A 5b1aA-3rr1A:
undetectable
5b1aJ-3rr1A:
undetectable		 5b1aA-3rr1A:
22.10
5b1aJ-3rr1A:
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.
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
 0.95A 5b1aA-3se7A:
undetectable
5b1aJ-3se7A:
undetectable		 5b1aA-3se7A:
21.97
5b1aJ-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.
3sto SERINE PROTEASE
INHIBITOR

(Schistosoma
haematobium) 		PF00079
(Serpin) 		4 LEU A  47
MET A 392
THR A 391
LEU A 390
 None
 0.97A 5b1aA-3stoA:
undetectable
5b1aJ-3stoA:
undetectable		 5b1aA-3stoA:
20.56
5b1aJ-3stoA:
9.14
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.
3sut BETA-HEXOSAMINIDASE

(Paenibacillus
sp. TS12) 		PF00728
(Glyco_hydro_20)
PF02838
(Glyco_hydro_20b) 		4 ILE A  40
LEU A  60
THR A  35
LEU A  34
 None
 0.92A 5b1aA-3sutA:
undetectable
5b1aJ-3sutA:
undetectable		 5b1aA-3sutA:
23.64
5b1aJ-3sutA:
8.94
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.
3t6q CD180 ANTIGEN

(Mus musculus) 		PF13855
(LRR_8) 		4 ILE A 352
LEU A 377
THR A 348
LEU A 372
 None
 0.88A 5b1aA-3t6qA:
undetectable
5b1aJ-3t6qA:
undetectable		 5b1aA-3t6qA:
19.07
5b1aJ-3t6qA:
7.06
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.
3v85 CYTH-LIKE
PHOSPHATASE

(Arabidopsis
thaliana) 		PF01928
(CYTH) 		4 ILE A 191
LEU A 186
THR A  23
LEU A  22
 None
 0.91A 5b1aA-3v85A:
undetectable
5b1aJ-3v85A:
undetectable		 5b1aA-3v85A:
17.05
5b1aJ-3v85A:
13.33
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.
3we7 PUTATIVE
UNCHARACTERIZED
PROTEIN PH0499

(Pyrococcus
horikoshii) 		PF02585
(PIG-L) 		4 ILE A 192
ARG A 125
THR A 129
LEU A 132
 None
 0.75A 5b1aA-3we7A:
undetectable
5b1aJ-3we7A:
undetectable		 5b1aA-3we7A:
18.46
5b1aJ-3we7A:
14.11
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.
3wib HALOALKANE
DEHALOGENASE

(Agrobacterium
fabrum) 		PF00561
(Abhydrolase_1) 		4 ILE A 261
LEU A 264
THR A 250
LEU A 249
 None
 0.88A 5b1aA-3wibA:
undetectable
5b1aJ-3wibA:
undetectable		 5b1aA-3wibA:
20.31
5b1aJ-3wibA:
11.89
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.
3x1l CRISPR SYSTEM CMR
SUBUNIT CMR2

(Pyrococcus
furiosus) 		PF12469
(DUF3692) 		4 ILE A 226
LEU A 249
ARG A 321
LEU A 326
 None
 0.88A 5b1aA-3x1lA:
undetectable
5b1aJ-3x1lA:
undetectable		 5b1aA-3x1lA:
19.89
5b1aJ-3x1lA:
6.91
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.
3zxs CRYPTOCHROME B

(Rhodobacter
sphaeroides) 		PF04244
(DPRP) 		5 LEU A 455
TYR A 439
ARG A 343
MET A 344
LEU A 347
 None
None
None
SF4  A1510 (-4.5A)
None
 1.37A 5b1aA-3zxsA:
undetectable
5b1aJ-3zxsA:
undetectable		 5b1aA-3zxsA:
22.32
5b1aJ-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.
4b4o EPIMERASE FAMILY
PROTEIN SDR39U1

(Homo sapiens) 		PF01370
(Epimerase)
PF08338
(DUF1731) 		4 ILE A 193
TYR A 277
THR A 203
LEU A 202
 None
 0.91A 5b1aA-4b4oA:
undetectable
5b1aJ-4b4oA:
undetectable		 5b1aA-4b4oA:
22.69
5b1aJ-4b4oA:
9.90
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.
4b8c GLUCOSE-REPRESSIBLE
ALCOHOL
DEHYDROGENASE
TRANSCRIPTIONAL
EFFECTOR

(Saccharomyces
cerevisiae) 		PF03372
(Exo_endo_phos)
PF13855
(LRR_8) 		4 ILE D 376
LEU D 399
THR D 370
LEU D 392
 None
 0.81A 5b1aA-4b8cD:
undetectable
5b1aJ-4b8cD:
undetectable		 5b1aA-4b8cD:
21.05
5b1aJ-4b8cD:
6.68
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.
4egw MAGNESIUM TRANSPORT
PROTEIN CORA

(Methanocaldococcus
jannaschii) 		PF01544
(CorA) 		4 ILE A  96
LEU A 101
ARG A 214
LEU A 140
 None
 0.94A 5b1aA-4egwA:
2.4
5b1aJ-4egwA:
undetectable		 5b1aA-4egwA:
18.58
5b1aJ-4egwA:
11.31
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.
4fdd TRANSPORTIN-1

(Homo sapiens) 		PF03810
(IBN_N)
PF13513
(HEAT_EZ) 		4 ILE A 440
ARG A 464
THR A 506
LEU A 507
 None
 0.77A 5b1aA-4fddA:
3.3
5b1aJ-4fddA:
undetectable		 5b1aA-4fddA:
20.07
5b1aJ-4fddA:
6.47
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.
4fho INTERNALIN C2

(Listeria
monocytogenes) 		PF12354
(Internalin_N)
PF12799
(LRR_4)
PF13516
(LRR_6) 		4 ILE A  78
LEU A  81
THR A 120
LEU A 119
 None
 0.96A 5b1aA-4fhoA:
undetectable
5b1aJ-4fhoA:
undetectable		 5b1aA-4fhoA:
18.22
5b1aJ-4fhoA:
14.83
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.
4fmz INTERNALIN

(Listeria
monocytogenes) 		PF12354
(Internalin_N)
PF12799
(LRR_4)
PF13855
(LRR_8) 		4 ILE A 128
LEU A 150
THR A 124
LEU A 145
 None
 0.84A 5b1aA-4fmzA:
undetectable
5b1aJ-4fmzA:
undetectable		 5b1aA-4fmzA:
20.75
5b1aJ-4fmzA:
11.14