SIMILAR PATTERNS OF AMINO ACIDS FOR 4A79_B_P1BB601

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.
1g38 MODIFICATION
METHYLASE TAQI

(Thermus
aquaticus) 		PF07669
(Eco57I)
PF12950
(TaqI_C) 		5 LEU A 215
ILE A 206
ILE A 243
PHE A 174
TYR A 140
 None
 1.45A 4a79B-1g38A:
1.5		 4a79B-1g38A:
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.
1mt5 FATTY-ACID AMIDE
HYDROLASE

(Rattus
norvegicus) 		PF01425
(Amidase) 		5 PRO A 338
LEU A 364
TYR A 330
PHE A 363
TYR A 454
 None
 1.03A 4a79B-1mt5A:
0.0		 4a79B-1mt5A:
19.52
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.
1o0s NAD-DEPENDENT MALIC
ENZYME

(Ascaris suum) 		PF00390
(malic)
PF03949
(Malic_M) 		5 LEU A 359
ILE A 335
ILE A 357
TYR A 323
TYR A 525
 None
 1.38A 4a79B-1o0sA:
0.0		 4a79B-1o0sA:
23.74
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1o5w AMINE OXIDASE
[FLAVIN-CONTAINING]
A

(Rattus
norvegicus) 		PF01593
(Amino_oxidase) 		7 PRO A 113
TRP A 128
GLN A 215
ILE A 325
PHE A 352
TYR A 407
TYR A 444
 None
None
MLG  A 709 (-3.8A)
None
None
MLG  A 709 ( 3.8A)
FAD  A 652 ( 4.5A)
 0.78A 4a79B-1o5wA:
61.0		 4a79B-1o5wA:
70.34
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.
1s58 B19 PARVOVIRUS
CAPSID

(Primate
erythroparvovirus
1) 		PF00740
(Parvo_coat) 		5 LEU A 149
LEU A  90
ILE A 123
PHE A  92
TYR A 161
 None
 1.42A 4a79B-1s58A:
undetectable		 4a79B-1s58A:
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.
1u2z HISTONE-LYSINE
N-METHYLTRANSFERASE,
H3 LYSINE-79
SPECIFIC

(Saccharomyces
cerevisiae) 		PF08123
(DOT1) 		5 PRO A 356
ILE A 210
PHE A 345
TYR A 445
TYR A 205
 None
 1.26A 4a79B-1u2zA:
undetectable		 4a79B-1u2zA:
20.87
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.
1v4g GLUTAMATE--CYSTEINE
LIGASE

(Escherichia
coli) 		PF04262
(Glu_cys_ligase) 		5 PRO A 305
LEU A 370
ILE A 251
ILE A 184
TYR A 188
 None
 1.29A 4a79B-1v4gA:
undetectable		 4a79B-1v4gA:
22.34
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.
1wcg THIOGLUCOSIDASE

(Brevicoryne
brassicae) 		PF00232
(Glyco_hydro_1) 		5 LEU A 358
LEU A 396
ILE A 372
TYR A 413
TYR A 454
 None
 1.38A 4a79B-1wcgA:
undetectable		 4a79B-1wcgA:
20.35
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.
1wdw TRYPTOPHAN SYNTHASE
BETA CHAIN 1

(Pyrococcus
furiosus) 		PF00291
(PALP) 		5 TRP B 172
LEU B  22
ILE B 183
ILE B 195
TYR B 301
 None
 1.23A 4a79B-1wdwB:
0.7		 4a79B-1wdwB:
20.34
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.
1wl1 OCTOPRENYL-DIPHOSPHA
TE SYNTHASE

(Thermotoga
maritima) 		PF00348
(polyprenyl_synt) 		5 PRO A  37
LEU A  79
GLN A  31
ILE A  96
TYR A 100
 None
 1.29A 4a79B-1wl1A:
undetectable		 4a79B-1wl1A:
20.15
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.
1xhb POLYPEPTIDE
N-ACETYLGALACTOSAMIN
YLTRANSFERASE 1

(Mus musculus) 		PF00535
(Glycos_transf_2)
PF00652
(Ricin_B_lectin) 		5 LEU A 443
LEU A 550
ILE A 476
TYR A 470
PHE A 429
 None
None
None
None
NAG  A 700 (-4.0A)
 1.32A 4a79B-1xhbA:
undetectable		 4a79B-1xhbA:
21.65
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.
1zy9 ALPHA-GALACTOSIDASE

(Thermotoga
maritima) 		PF02065
(Melibiase) 		5 PRO A 260
LEU A 329
LEU A 366
GLN A 218
ILE A 326
 None
 1.43A 4a79B-1zy9A:
undetectable		 4a79B-1zy9A:
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.
2aak UBIQUITIN
CONJUGATING ENZYME

(Arabidopsis
thaliana) 		PF00179
(UQ_con) 		5 LEU A  55
LEU A 113
ILE A  81
ILE A 109
TYR A 137
 None
 1.42A 4a79B-2aakA:
undetectable		 4a79B-2aakA:
13.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2b3d MODULATOR OF DRUG
ACTIVITY B

(Escherichia
coli) 		PF02525
(Flavodoxin_2) 		5 LEU A  43
LEU A  16
ILE A  52
ILE A  75
PHE A  68
 None
 1.38A 4a79B-2b3dA:
undetectable		 4a79B-2b3dA:
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.
2b3x IRON-RESPONSIVE
ELEMENT BINDING
PROTEIN 1

(Homo sapiens) 		PF00330
(Aconitase)
PF00694
(Aconitase_C) 		5 PRO A 171
GLN A 179
ILE A 616
TYR A 613
PHE A 609
 None
 0.94A 4a79B-2b3xA:
undetectable		 4a79B-2b3xA:
20.44
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.
2bfw GLGA GLYCOGEN
SYNTHASE

(Pyrococcus
abyssi) 		PF00534
(Glycos_transf_1) 		5 LEU A 275
LEU A 268
ILE A 387
PHE A 254
TYR A 337
 None
 1.38A 4a79B-2bfwA:
undetectable		 4a79B-2bfwA:
16.51
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.
2bmb FOLIC ACID SYNTHESIS
PROTEIN FOL1

(Saccharomyces
cerevisiae) 		PF00809
(Pterin_bind)
PF01288
(HPPK) 		5 LEU A 461
LEU A 470
CYH A 471
PHE A 341
TYR A 792
 None
 1.25A 4a79B-2bmbA:
undetectable		 4a79B-2bmbA:
21.44
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2cdp BETA-AGARASE 1

(Saccharophagus
degradans) 		PF03422
(CBM_6) 		5 PRO A  93
LEU A 131
TYR A  63
PHE A 134
TYR A  49
 None
 1.45A 4a79B-2cdpA:
undetectable		 4a79B-2cdpA:
14.67
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.
2h4t CARNITINE
O-PALMITOYLTRANSFERA
SE II, MITOCHONDRIAL

(Rattus
norvegicus) 		PF00755
(Carn_acyltransf) 		5 PRO A  70
LEU A  71
LEU A 587
PHE A 636
TYR A 614
 None
 1.41A 4a79B-2h4tA:
undetectable		 4a79B-2h4tA:
21.29
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.
2iuj LIPOXYGENASE L-5

(Glycine max) 		PF00305
(Lipoxygenase)
PF01477
(PLAT) 		5 PRO A 132
LEU A  60
ILE A 107
ILE A  11
PHE A 111
 None
 1.29A 4a79B-2iujA:
undetectable		 4a79B-2iujA:
20.51
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.
2j6i FORMATE
DEHYDROGENASE

([Candida]
boidinii) 		PF00389
(2-Hacid_dh)
PF02826
(2-Hacid_dh_C) 		5 LEU A  41
LEU A   7
CYH A  23
GLN A 320
ILE A  65
 None
 1.43A 4a79B-2j6iA:
undetectable		 4a79B-2j6iA:
21.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2jcb 5-FORMYLTETRAHYDROFO
LATE CYCLO-LIGASE
FAMILY PROTEIN

(Bacillus
anthracis) 		PF01812
(5-FTHF_cyc-lig) 		5 LEU A  35
ILE A  47
ILE A  62
TYR A 143
TYR A 146
 None
None
None
PO4  A1191 (-4.7A)
None
 1.43A 4a79B-2jcbA:
undetectable		 4a79B-2jcbA:
17.27
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.
2lf8 TRANSCRIPTION FACTOR
ETV6

(Mus musculus) 		PF00178
(Ets) 		5 LEU A 430
LEU A 394
ILE A 402
PHE A 413
TYR A 387
 None
 1.43A 4a79B-2lf8A:
undetectable		 4a79B-2lf8A:
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.
2nqw CBS DOMAIN PROTEIN

(Porphyromonas
gingivalis) 		PF03471
(CorC_HlyC) 		5 PRO A  58
LEU A  51
LEU A  46
ILE A  81
PHE A  16
 None
 1.27A 4a79B-2nqwA:
undetectable		 4a79B-2nqwA:
11.96
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.
2pjd RIBOSOMAL RNA SMALL
SUBUNIT
METHYLTRANSFERASE C

(Escherichia
coli) 		PF05175
(MTS)
PF08468
(MTS_N) 		5 PRO A 269
LEU A 285
LEU A 313
ILE A 301
TYR A 332
 None
 1.19A 4a79B-2pjdA:
undetectable		 4a79B-2pjdA:
20.73
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.
2vl6 MINICHROMOSOME
MAINTENANCE PROTEIN
MCM

(Sulfolobus
solfataricus) 		PF14551
(MCM_N)
PF17207
(MCM_OB) 		5 LEU A  37
ILE A  93
ILE A  82
TYR A  79
TYR A 138
 None
 1.07A 4a79B-2vl6A:
undetectable		 4a79B-2vl6A:
19.35
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.
2vvf MAJOR CAPSID PROTEIN
P2

(Pseudoalteromonas
virus PM2) 		no annotation 5 PRO A 141
LEU A  51
LEU A  23
ILE A  25
TYR A  29
 None
 1.32A 4a79B-2vvfA:
undetectable		 4a79B-2vvfA:
18.99
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.
2wqq ALPHA-2,3-/2,8-SIALY
LTRANSFERASE

(Campylobacter
jejuni) 		PF06002
(CST-I) 		5 PRO A  22
LEU A 211
CYH A 137
ILE A   5
PHE A  49
 None
 1.36A 4a79B-2wqqA:
undetectable		 4a79B-2wqqA:
18.97
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.
2x7j 2-SUCCINYL-5-ENOLPYR
UVYL-6-HYDROXY-3-CYC
LOHEXENE
-1-CARBOXYLATE
SYNTHASE

(Bacillus
subtilis) 		PF02775
(TPP_enzyme_C)
PF02776
(TPP_enzyme_N)
PF16582
(TPP_enzyme_M_2) 		5 PRO A 138
LEU A 173
LEU A  39
CYH A  40
ILE A   6
 None
 1.31A 4a79B-2x7jA:
undetectable		 4a79B-2x7jA:
22.05
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.
2xko GLOBAL NITROGEN
REGULATOR

(Synechococcus
elongatus) 		PF00027
(cNMP_binding)
PF13545
(HTH_Crp_2) 		5 LEU A 148
LEU A 155
CYH A 156
ILE A 209
ILE A 178
 None
 0.75A 4a79B-2xkoA:
undetectable		 4a79B-2xkoA:
16.82
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.
2y0n MALE-SPECIFIC LETHAL
1 HOMOLOG
MALE-SPECIFIC LETHAL
3 HOMOLOG

(Homo sapiens;
Mus musculus) 		PF05712
(MRG)
no annotation 		5 PRO E 582
LEU E 584
LEU A 459
ILE A 466
PHE A 460
 None
 1.13A 4a79B-2y0nE:
undetectable		 4a79B-2y0nE:
7.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2yy7 L-THREONINE
DEHYDROGENASE

(Flavobacterium
frigidimaris) 		PF01370
(Epimerase) 		5 LEU A  18
ILE A   5
TYR A  73
PHE A 114
TYR A 170
 None
 1.44A 4a79B-2yy7A:
3.1		 4a79B-2yy7A:
20.30
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2z5x AMINE OXIDASE
[FLAVIN-CONTAINING]
A

(Homo sapiens) 		PF01593
(Amino_oxidase) 		7 PRO A 113
TRP A 128
GLN A 215
ILE A 325
PHE A 352
TYR A 407
TYR A 444
 None
None
HRM  A 700 (-3.4A)
None
HRM  A 700 (-4.3A)
HRM  A 700 ( 3.9A)
FAD  A 600 ( 4.6A)
 0.55A 4a79B-2z5xA:
61.8		 4a79B-2z5xA:
72.53
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.
2z87 CHONDROITIN SYNTHASE

(Escherichia
coli) 		PF00535
(Glycos_transf_2) 		5 LEU A 165
LEU A 172
CYH A 173
ILE A 207
ILE A 156
 None
 0.89A 4a79B-2z87A:
undetectable		 4a79B-2z87A:
22.88
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.
3ci0 PSEUDOPILIN GSPK

(Escherichia
coli) 		PF03934
(T2SSK) 		5 TRP K 279
LEU K 199
LEU K 172
ILE K 175
PHE K 140
 None
 1.40A 4a79B-3ci0K:
undetectable		 4a79B-3ci0K:
20.20
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.
3gyx ADENYLYLSULFATE
REDUCTASE

(Desulfovibrio
gigas) 		PF00890
(FAD_binding_2) 		5 PRO A  18
LEU A 507
ILE A 511
ILE A  20
PHE A 500
 None
 1.29A 4a79B-3gyxA:
7.7		 4a79B-3gyxA:
22.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3h7t GROUP 3 ALLERGEN
SMIPP-S YVT004A06

(Sarcoptes
scabiei) 		PF00089
(Trypsin) 		5 LEU A 196
LEU A 215
ILE A  37
TYR A  86
TYR A 166
 None
 1.07A 4a79B-3h7tA:
undetectable		 4a79B-3h7tA:
18.20
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.
3i9v NADH-QUINONE
OXIDOREDUCTASE
SUBUNIT 4

(Thermus
thermophilus) 		PF00346
(Complex1_49kDa) 		5 LEU 4 126
LEU 4 133
ILE 4 201
TYR 4 204
PHE 4 208
 None
 1.43A 4a79B-3i9v4:
undetectable		 4a79B-3i9v4:
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.
3iu1 GLYCYLPEPTIDE
N-TETRADECANOYLTRANS
FERASE 1

(Homo sapiens) 		PF01233
(NMT)
PF02799
(NMT_C) 		5 PRO A 203
TRP A 199
LEU A 495
ILE A 229
TYR A 476
 None
 1.28A 4a79B-3iu1A:
undetectable		 4a79B-3iu1A:
20.37
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.
3kby PUTATIVE
UNCHARACTERIZED
PROTEIN

(Staphylococcus
aureus) 		PF10804
(DUF2538) 		5 PRO A  73
TRP A  76
LEU A  56
TYR A 133
PHE A 130
 None
 1.26A 4a79B-3kbyA:
undetectable		 4a79B-3kbyA:
13.65
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.
3kcn ADENYLATE CYCLASE
HOMOLOG

(Rhodopirellula
baltica) 		PF00072
(Response_reg) 		5 LEU A  11
LEU A  82
ILE A 115
ILE A   9
PHE A 103
 None
 0.93A 4a79B-3kcnA:
undetectable		 4a79B-3kcnA:
15.34
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.
3l01 GLGA GLYCOGEN
SYNTHASE

(Pyrococcus
abyssi) 		PF00534
(Glycos_transf_1)
PF08323
(Glyco_transf_5) 		5 LEU A 275
LEU A 268
ILE A 387
PHE A 254
TYR A 337
 None
 1.38A 4a79B-3l01A:
undetectable		 4a79B-3l01A:
21.11
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.
3la2 GLOBAL NITROGEN
REGULATOR

(Nostoc sp. PCC
7120) 		PF00027
(cNMP_binding)
PF13545
(HTH_Crp_2) 		5 LEU A 149
LEU A 156
CYH A 157
ILE A 210
ILE A 179
 None
 0.79A 4a79B-3la2A:
undetectable		 4a79B-3la2A:
17.90
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.
3m1c ENVELOPE
GLYCOPROTEIN H

(Human
alphaherpesvirus
2) 		PF02489
(Herpes_glycop_H)
PF17488
(Herpes_glycoH_C) 		5 PRO A 588
LEU A 510
LEU A 505
ILE A 549
PHE A 770
 None
 1.20A 4a79B-3m1cA:
undetectable		 4a79B-3m1cA:
21.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3nh9 ATP-BINDING CASSETTE
SUB-FAMILY B MEMBER
6, MITOCHONDRIAL

(Homo sapiens) 		PF00005
(ABC_tran) 		5 LEU A 621
LEU A 749
ILE A 590
ILE A 632
PHE A 637
 None
None
None
None
BME  A   2 ( 4.4A)
 1.42A 4a79B-3nh9A:
undetectable		 4a79B-3nh9A:
19.13
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.
3o21 GLUTAMATE RECEPTOR 3

(Rattus
norvegicus) 		PF01094
(ANF_receptor) 		5 PRO A 115
LEU A 281
ILE A 342
GLN A 336
ILE A 244
 None
None
None
NAG  A 390 ( 3.9A)
None
 1.35A 4a79B-3o21A:
undetectable		 4a79B-3o21A:
21.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3qr1 PHOSPHOLIPASE C-BETA
(PLC-BETA)

(Doryteuthis
pealeii) 		PF00168
(C2)
PF00387
(PI-PLC-Y)
PF00388
(PI-PLC-X)
PF09279
(EF-hand_like) 		5 TRP A 133
LEU A  43
LEU A  65
ILE A  73
ILE A 120
 None
 1.38A 4a79B-3qr1A:
undetectable		 4a79B-3qr1A:
20.44
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3rha PUTRESCINE OXIDASE

(Paenarthrobacter
aurescens) 		PF01593
(Amino_oxidase) 		5 LEU A 154
LEU A 169
ILE A 171
ILE A 167
PHE A 317
 None
 1.27A 4a79B-3rhaA:
48.9		 4a79B-3rhaA:
30.84
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.
3rm5 HYDROXYMETHYLPYRIMID
INE/PHOSPHOMETHYLPYR
IMIDINE KINASE THI20

(Saccharomyces
cerevisiae) 		PF03070
(TENA_THI-4)
PF08543
(Phos_pyr_kin) 		5 LEU A 513
LEU A 465
ILE A 406
PHE A 449
TYR A 379
 None
 1.24A 4a79B-3rm5A:
undetectable		 4a79B-3rm5A:
21.95
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.
3ujz METALLOPROTEASE STCE

(Escherichia
coli) 		PF10462
(Peptidase_M66) 		5 PRO A 890
LEU A 851
LEU A 820
ILE A 809
TYR A 818
 None
 1.36A 4a79B-3ujzA:
undetectable		 4a79B-3ujzA:
21.05
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.
3vi1 ALKALINE
METALLOPROTEINASE

(Pseudomonas
aeruginosa) 		PF08548
(Peptidase_M10_C)
PF13583
(Reprolysin_4) 		5 LEU A 415
LEU A 404
ILE A 381
ILE A 445
TYR A 359
 None
 1.21A 4a79B-3vi1A:
undetectable		 4a79B-3vi1A:
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.
3vkg DYNEIN HEAVY CHAIN,
CYTOPLASMIC

(Dictyostelium
discoideum) 		PF03028
(Dynein_heavy)
PF07728
(AAA_5)
PF08393
(DHC_N2)
PF12774
(AAA_6)
PF12775
(AAA_7)
PF12777
(MT)
PF12780
(AAA_8)
PF12781
(AAA_9) 		5 LEU A4248
LEU A4375
ILE A4280
GLN A4362
PHE A4373
 None
 1.21A 4a79B-3vkgA:
undetectable		 4a79B-3vkgA:
10.14
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3zyx AMINE OXIDASE
[FLAVIN-CONTAINING]
B

(Homo sapiens) 		PF01593
(Amino_oxidase) 		10 PRO A 104
TRP A 119
LEU A 164
LEU A 171
CYH A 172
GLN A 206
ILE A 316
PHE A 343
TYR A 398
TYR A 435
 None
None
None
MBT  A 601 (-4.2A)
None
MBT  A 601 (-3.4A)
MBT  A 601 (-4.6A)
MBT  A 601 (-4.7A)
MBT  A 601 ( 3.6A)
MBT  A 601 ( 4.6A)
 0.43A 4a79B-3zyxA:
64.7		 4a79B-3zyxA:
99.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4a2w RETINOIC ACID
INDUCIBLE PROTEIN I

(Anas
platyrhynchos) 		PF00270
(DEAD)
PF00271
(Helicase_C)
PF16739
(CARD_2) 		5 LEU A 129
LEU A 121
ILE A 154
ILE A 137
TYR A 178
 None
 1.46A 4a79B-4a2wA:
undetectable		 4a79B-4a2wA:
19.52
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.
4bm1 MANGANESE PEROXIDASE
4

(Pleurotus
ostreatus) 		PF00141
(peroxidase)
PF11895
(Peroxidase_ext) 		5 PRO A 320
LEU A 322
ILE A 310
ILE A 255
PHE A 204
 None
 1.27A 4a79B-4bm1A:
undetectable		 4a79B-4bm1A:
19.55
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.
4c2x GLYCYLPEPTIDE
N-TETRADECANOYLTRANS
FERASE 2

(Homo sapiens) 		PF01233
(NMT)
PF02799
(NMT_C) 		5 PRO A 203
TRP A 199
LEU A 495
ILE A 229
TYR A 476
 None
 1.26A 4a79B-4c2xA:
undetectable		 4a79B-4c2xA:
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.
4cgs POLYMERASE SUBUNIT
PA

(Dhori
thogotovirus) 		no annotation 5 PRO A   6
LEU A 160
LEU A 124
ILE A 151
ILE A  34
 None
 1.26A 4a79B-4cgsA:
undetectable		 4a79B-4cgsA:
14.87
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.
4cjx C-1-TETRAHYDROFOLATE
SYNTHASE,
CYTOPLASMIC,
PUTATIVE

(Trypanosoma
brucei) 		PF00763
(THF_DHG_CYH)
PF02882
(THF_DHG_CYH_C) 		5 LEU A  81
LEU A  88
ILE A 116
ILE A  41
PHE A  68
 None
 1.25A 4a79B-4cjxA:
undetectable		 4a79B-4cjxA:
20.85
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.
4eoc PHYCOCYANOBILIN:FERR
EDOXIN
OXIDOREDUCTASE

(Synechocystis
sp. PCC 6803) 		PF05996
(Fe_bilin_red) 		5 PRO A 167
CYH A 104
ILE A 106
ILE A 165
PHE A 158
 None
None
None
None
BLA  A1001 (-4.4A)
 1.28A 4a79B-4eocA:
undetectable		 4a79B-4eocA:
15.77
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.
4eyo EXTRACELLULAR
LIGAND-BINDING
RECEPTOR

(Rhodopseudomonas
palustris) 		PF13458
(Peripla_BP_6) 		5 PRO A 229
LEU A 233
ILE A 164
TYR A 163
TYR A 150
 None
 1.34A 4a79B-4eyoA:
undetectable		 4a79B-4eyoA:
20.90
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.
4gve NUCLEOPROTEIN

(Tacaribe
mammarenavirus) 		PF17290
(Arena_ncap_C) 		5 PRO A 394
LEU A 443
LEU A 468
ILE A 470
ILE A 387
 None
 1.23A 4a79B-4gveA:
undetectable		 4a79B-4gveA:
19.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4hyv PYRUVATE KINASE 1

(Trypanosoma
brucei) 		PF00224
(PK)
PF02887
(PK_C) 		5 LEU A 180
LEU A 151
CYH A 164
ILE A 178
PHE A 102
 None
 1.21A 4a79B-4hyvA:
undetectable		 4a79B-4hyvA:
23.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4iyo CYSTATHIONINE
GAMMA-LYASE-LIKE
PROTEIN, LYS201A
MODIFIED

(Xanthomonas
oryzae) 		PF01053
(Cys_Met_Meta_PP) 		5 PRO B 262
LEU B  76
LEU B 255
ILE B  22
PHE B 252
 None
 1.39A 4a79B-4iyoB:
undetectable		 4a79B-4iyoB:
21.56
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.
4m1n UBIQUITIN
CONJUGATING ENZYME
UBC9

(Plasmodium
falciparum) 		PF00179
(UQ_con) 		5 LEU A  60
LEU A 120
ILE A  86
ILE A 116
TYR A 144
 None
 1.32A 4a79B-4m1nA:
undetectable		 4a79B-4m1nA:
15.65
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.
4ose PUTATIVE HYDROLASE

(Rickettsia
typhi) 		PF00561
(Abhydrolase_1) 		5 PRO A 106
TRP A 108
LEU A  40
ILE A 103
TYR A  11
 None
 1.39A 4a79B-4oseA:
undetectable		 4a79B-4oseA:
20.15
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.
4ose PUTATIVE HYDROLASE

(Rickettsia
typhi) 		PF00561
(Abhydrolase_1) 		5 PRO A 106
TRP A 108
LEU A  40
ILE A 128
ILE A 103
 None
 1.46A 4a79B-4oseA:
undetectable		 4a79B-4oseA:
20.15
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.
4q05 ESTERASE E25

(uncultured
bacterium) 		PF07859
(Abhydrolase_3) 		5 PRO A 272
LEU A 210
LEU A 195
ILE A 200
PHE A 165
 None
 1.40A 4a79B-4q05A:
undetectable		 4a79B-4q05A:
21.39
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.
4q85 RIBOSOMAL PROTEIN
S12
METHYLTHIOTRANSFERAS
E ACCESSORY FACTOR
YCAO

(Escherichia
coli) 		PF02624
(YcaO) 		5 LEU A 449
LEU A 462
ILE A 464
ILE A 414
TYR A 504
 None
 1.19A 4a79B-4q85A:
undetectable		 4a79B-4q85A:
21.50
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.
4qfh GLUCOSE-6-PHOSPHATE
ISOMERASE

(Trypanosoma
cruzi) 		PF00342
(PGI) 		5 LEU A 399
LEU A 406
GLN A 390
ILE A 543
TYR A 547
 None
 1.38A 4a79B-4qfhA:
undetectable		 4a79B-4qfhA:
22.31
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.
4rh7 GREEN FLUORESCENT
PROTEIN/CYTOPLASMIC
DYNEIN 2 HEAVY CHAIN
1

(Homo sapiens;
synthetic
construct) 		PF03028
(Dynein_heavy)
PF07728
(AAA_5)
PF08393
(DHC_N2)
PF12774
(AAA_6)
PF12775
(AAA_7)
PF12777
(MT)
PF12780
(AAA_8)
PF12781
(AAA_9) 		5 LEU A2730
LEU A2710
GLN A2716
ILE A2726
PHE A2677
 None
 1.44A 4a79B-4rh7A:
undetectable		 4a79B-4rh7A:
9.42
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.
4rm4 CYTOCHROME P450

(Bacillus
subtilis) 		PF00067
(p450) 		5 PRO A 138
LEU A 119
LEU A 366
ILE A 248
TYR A 262
 None
 1.19A 4a79B-4rm4A:
undetectable		 4a79B-4rm4A:
22.52
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.
4s0v HUMAN OREXIN
RECEPTOR TYPE 2
FUSION PROTEIN TO P.
ABYSII GLYCOGEN
SYNTHASE

(Homo sapiens;
Pyrococcus
abyssi) 		PF00001
(7tm_1)
PF00534
(Glycos_transf_1) 		5 LEU A1058
LEU A1051
ILE A1170
PHE A1037
TYR A1120
 None
 1.35A 4a79B-4s0vA:
undetectable		 4a79B-4s0vA:
21.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4trq NUCLEAR MRNA EXPORT
PROTEIN SAC3
NUCLEAR MRNA EXPORT
PROTEIN THP1

(Saccharomyces
cerevisiae) 		PF01399
(PCI)
PF03399
(SAC3_GANP) 		5 PRO B 419
LEU A 465
LEU A 458
ILE A 472
PHE A 492
 None
 1.05A 4a79B-4trqB:
undetectable		 4a79B-4trqB:
20.23
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.
4uzg SURFACE PROTEIN SPB1

(Streptococcus
agalactiae) 		no annotation 5 PRO A 458
LEU A 421
ILE A 409
ILE A 354
PHE A 384
 None
None
None
None
EDO  A1472 ( 4.8A)
 1.40A 4a79B-4uzgA:
undetectable		 4a79B-4uzgA:
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.
4xe3 CYTOCHROME P-450

(Streptomyces
antibioticus) 		PF00067
(p450) 		5 PRO A 151
LEU A 131
LEU A 373
ILE A 253
TYR A 267
 None
 1.33A 4a79B-4xe3A:
undetectable		 4a79B-4xe3A:
20.96
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.
4xvm DNA POLYMERASE NU

(Homo sapiens) 		PF00476
(DNA_pol_A) 		5 LEU A 842
ILE A 631
PHE A 654
TYR A 682
TYR A 686
 None
 1.40A 4a79B-4xvmA:
undetectable		 4a79B-4xvmA:
21.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4xz8 NUCLEOPROTEIN

(Thiafora
orthonairovirus) 		PF02477
(Nairo_nucleo) 		5 LEU A  17
ILE A   5
ILE A  77
TYR A 143
TYR A 306
 None
 1.46A 4a79B-4xz8A:
undetectable		 4a79B-4xz8A:
22.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4zch TUMOR NECROSIS
FACTOR LIGAND
SUPERFAMILY MEMBER
13,TUMOR NECROSIS
FACTOR LIGAND
SUPERFAMILY MEMBER
13B,TUMOR NECROSIS
FACTOR LIGAND
SUPERFAMILY MEMBER
13B

(Homo sapiens) 		PF00229
(TNF) 		5 LEU A 186
ILE A 203
ILE A 193
PHE A 286
TYR A 405
 None
 1.31A 4a79B-4zchA:
undetectable		 4a79B-4zchA:
21.50
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.
4zj8 HUMAN OX1R FUSION
PROTEIN TO P.ABYSII
GLYCOGEN SYNTHASE

(Homo sapiens;
Pyrococcus
abyssi) 		PF00001
(7tm_1)
PF00534
(Glycos_transf_1) 		5 LEU A1058
LEU A1051
ILE A1170
PHE A1037
TYR A1120
 None
 1.39A 4a79B-4zj8A:
undetectable		 4a79B-4zj8A:
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.
5co8 NUCLEASE-LIKE
PROTEIN

(Chaetomium
thermophilum) 		PF00752
(XPG_N)
PF00867
(XPG_I) 		5 PRO A  32
LEU A 339
LEU A  68
ILE A  72
PHE A 110
 None
 1.42A 4a79B-5co8A:
undetectable		 4a79B-5co8A:
22.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5e43 BETA-LACTAMASE

(Streptosporangium
roseum) 		PF13354
(Beta-lactamase2) 		5 TRP A 230
LEU A 226
LEU A 287
ILE A 260
ILE A 222
 None
 1.23A 4a79B-5e43A:
undetectable		 4a79B-5e43A:
21.14
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.
5h7j ELONGATION FACTOR 2

(Pyrococcus
horikoshii) 		no annotation 5 LEU A  95
LEU A 259
ILE A 115
ILE A 119
TYR A 268
 None
 1.29A 4a79B-5h7jA:
undetectable		 4a79B-5h7jA:
9.42
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.
5itg SORBITOL
DEHYDROGENASE

(Gluconobacter
oxydans) 		PF01232
(Mannitol_dh)
PF08125
(Mannitol_dh_C) 		5 PRO A 274
LEU A 276
ILE A  28
ILE A  48
TYR A  82
 None
 1.35A 4a79B-5itgA:
undetectable		 4a79B-5itgA:
20.14
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.
5ixq RECEPTOR-LIKE
PROTEIN KINASE 5

(Arabidopsis
thaliana) 		PF08263
(LRRNT_2)
PF13855
(LRR_8) 		5 PRO A 348
LEU A 351
LEU A 312
ILE A 327
PHE A 289
 None
 1.31A 4a79B-5ixqA:
undetectable		 4a79B-5ixqA:
22.50
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.
5jxr CHROMATIN-REMODELING
COMPLEX ATPASE-LIKE
PROTEIN

(Thermothelomyces
thermophila) 		PF00176
(SNF2_N)
PF00271
(Helicase_C) 		5 LEU A 225
LEU A 239
ILE A 290
ILE A 312
PHE A 333
 None
 1.14A 4a79B-5jxrA:
undetectable		 4a79B-5jxrA:
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.
5k0w CLASS B
CARBAPENEMASE GOB-18

(Elizabethkingia
meningoseptica) 		PF00753
(Lactamase_B) 		5 LEU A  94
LEU A  56
ILE A  77
ILE A  91
PHE A  86
 None
 1.42A 4a79B-5k0wA:
undetectable		 4a79B-5k0wA:
19.35
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.
5kbm CELL SURFACE CU-ONLY
SUPEROXIDE DISMUTASE
5

(Candida
albicans) 		PF00080
(Sod_Cu) 		5 PRO A  66
LEU A 160
ILE A 121
ILE A  42
TYR A 130
 SO4  A 202 ( 4.6A)
None
None
None
None
 1.32A 4a79B-5kbmA:
undetectable		 4a79B-5kbmA:
16.30
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.
5l6s GLUCOSE-1-PHOSPHATE
ADENYLYLTRANSFERASE

(Escherichia
coli) 		PF00483
(NTP_transferase) 		5 LEU A  80
ILE A  24
ILE A  84
PHE A  98
TYR A 131
 None
 1.31A 4a79B-5l6sA:
undetectable		 4a79B-5l6sA:
23.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5l73 NEUROPILIN-1

(Homo sapiens) 		PF00629
(MAM) 		5 PRO A 682
LEU A 676
GLN A 696
ILE A 683
TYR A 694
 None
 1.38A 4a79B-5l73A:
undetectable		 4a79B-5l73A:
14.89
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.
5nkm PROTEIN SMG-8

(Caenorhabditis
elegans) 		PF10220
(Smg8_Smg9) 		5 LEU E  45
LEU E 295
ILE E  72
ILE E  41
PHE E 294
 None
None
EDO  E 501 ( 4.9A)
None
None
 1.21A 4a79B-5nkmE:
undetectable		 4a79B-5nkmE:
20.98
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.
5of4 TFIIH BASAL
TRANSCRIPTION FACTOR
COMPLEX HELICASE XPD
SUBUNIT

(Homo sapiens) 		PF06733
(DEAD_2)
PF06777
(HBB)
PF13307
(Helicase_C_2) 		5 ILE B 432
GLN B 347
ILE B 417
PHE B 357
TYR B 339
 None
 1.28A 4a79B-5of4B:
undetectable		 4a79B-5of4B:
22.58
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.
5u09 CANNABINOID RECEPTOR
1,GLGA GLYCOGEN
SYNTHASE

(Homo sapiens;
Pyrococcus
abyssi) 		PF00001
(7tm_1)
PF00534
(Glycos_transf_1) 		5 LEU A1058
LEU A1051
ILE A1170
PHE A1037
TYR A1120
 None
 1.37A 4a79B-5u09A:
undetectable		 4a79B-5u09A:
21.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ufy ACYLTRANSFERASE

(Streptococcus
pneumoniae) 		no annotation 5 TRP A 500
LEU A 515
LEU A 507
ILE A 548
TYR A 547
 None
 1.32A 4a79B-5ufyA:
undetectable		 4a79B-5ufyA:
18.01
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.
5ug1 ACYLTRANSFERASE

(Streptococcus
pneumoniae) 		no annotation 5 TRP A 500
LEU A 515
LEU A 507
ILE A 548
TYR A 547
 None
 1.30A 4a79B-5ug1A:
undetectable		 4a79B-5ug1A:
16.34
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.
5v4a GLYCOSYLTRANSFERASE
(DUF1792)

(Streptococcus
sanguinis) 		PF08759
(GT-D) 		5 LEU A 207
ILE A 169
ILE A 196
PHE A 160
TYR A 263
 None
 1.46A 4a79B-5v4aA:
undetectable		 4a79B-5v4aA:
19.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5x6o SERINE/THREONINE-PRO
TEIN KINASE MEC1

(Saccharomyces
cerevisiae) 		no annotation 5 LEU C 712
LEU C 683
ILE C 687
ILE C 669
TYR C 900
 None
 1.16A 4a79B-5x6oC:
undetectable		 4a79B-5x6oC:
9.09
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.
6ans UNCHARACTERIZED
PROTEIN

(Burkholderia
cenocepacia) 		PF06742
(DUF1214) 		5 PRO A 355
LEU A 238
LEU A 332
CYH A 303
ILE A 272
 None
 1.45A 4a79B-6ansA:
undetectable		 4a79B-6ansA:
20.11
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.
6avh GH3.15 ACYL ACID
AMIDO SYNTHETASE

(Arabidopsis
thaliana) 		no annotation 5 PRO A 393
LEU A 410
ILE A 350
PHE A 325
TYR A 125
 None
 1.25A 4a79B-6avhA:
undetectable		 4a79B-6avhA:
10.11
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.
6en4 SPLICING FACTOR 3B
SUBUNIT 3

(Homo sapiens) 		no annotation 5 LEU A1091
CYH A 410
ILE A1108
ILE A1110
TYR A1101
 None
 1.26A 4a79B-6en4A:
undetectable		 4a79B-6en4A:
11.62
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.
6fur HUMAN F11 T-CELL
RECEPTOR

(Homo sapiens) 		no annotation 5 PRO B   7
LEU B  75
ILE B  18
GLN B  84
TYR B  88
 GOL  B 306 ( 4.8A)
None
None
None
None
 1.44A 4a79B-6furB:
undetectable		 4a79B-6furB:
9.33