SIMILAR PATTERNS OF AMINO ACIDS FOR 6FGD_A_ACTA812

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.
1a3x PYRUVATE KINASE

(Saccharomyces
cerevisiae) 		PF00224
(PK)
PF02887
(PK_C) 		4 GLU A  72
ARG A  68
LYS A  69
VAL A  38
 None
 1.45A 6fgdA-1a3xA:
undetectable		 6fgdA-1a3xA:
23.42
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.
1dll TETANUS TOXIN

(Clostridium
tetani) 		PF07951
(Toxin_R_bind_C)
PF07953
(Toxin_R_bind_N) 		4 ARG A 957
LYS A1030
VAL A1306
PRO A1307
 None
 1.49A 6fgdA-1dllA:
undetectable		 6fgdA-1dllA:
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.
1dot DUCK OVOTRANSFERRIN

(Anas
platyrhynchos) 		PF00405
(Transferrin) 		4 LYS A 654
PHE A 656
VAL A 408
PRO A 409
 None
 1.48A 6fgdA-1dotA:
2.6		 6fgdA-1dotA:
20.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1eth TRIACYLGLYCEROL
ACYL-HYDROLASE

(Sus scrofa) 		PF00151
(Lipase)
PF01477
(PLAT) 		4 GLU A 386
ARG A 340
PHE A 292
VAL A 291
 None
 1.41A 6fgdA-1ethA:
2.9		 6fgdA-1ethA:
22.15
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.
1f0k UDP-N-ACETYLGLUCOSAM
INE-N-ACETYLMURAMYL-
(PENTAPEPTIDE)
PYROPHOSPHORYL-UNDEC
APRENOL
N-ACETYLGLUCOSAMINE
TRANSFERASE

(Escherichia
coli) 		PF03033
(Glyco_transf_28)
PF04101
(Glyco_tran_28_C) 		4 GLU A 297
LYS A 303
PHE A 279
PRO A 281
 None
 0.76A 6fgdA-1f0kA:
3.5		 6fgdA-1f0kA:
21.94
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.
1jjf ENDO-1,4-BETA-XYLANA
SE Z

(Ruminiclostridium
thermocellum) 		PF00756
(Esterase) 		4 GLU A  99
ARG A  68
PHE A  98
VAL A 106
 None
 1.39A 6fgdA-1jjfA:
undetectable		 6fgdA-1jjfA:
20.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1jsw L-ASPARTATE
AMMONIA-LYASE

(Escherichia
coli) 		PF00206
(Lyase_1)
PF10415
(FumaraseC_C) 		4 GLU A 112
PHE A  93
VAL A  95
PRO A  94
 None
 1.41A 6fgdA-1jswA:
undetectable		 6fgdA-1jswA:
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.
1lrw METHANOL
DEHYDROGENASE
SUBUNIT 1

(Paracoccus
denitrificans) 		PF01011
(PQQ)
PF13360
(PQQ_2) 		4 ARG A  99
PHE A  71
VAL A 107
PRO A  70
 None
None
PQQ  A 701 (-4.7A)
None
 1.27A 6fgdA-1lrwA:
undetectable		 6fgdA-1lrwA:
22.68
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.
1m9i ANNEXIN VI

(Homo sapiens) 		PF00191
(Annexin) 		4 GLU A  57
ARG A  53
PHE A  17
PRO A  18
 None
 1.41A 6fgdA-1m9iA:
undetectable		 6fgdA-1m9iA:
20.78
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.
1poi GLUTACONATE COENZYME
A-TRANSFERASE

(Acidaminococcus
fermentans) 		PF01144
(CoA_trans) 		4 GLU A  99
ARG A 141
VAL A 168
PRO A 169
 None
 1.39A 6fgdA-1poiA:
undetectable		 6fgdA-1poiA:
22.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1qrz PLASMINOGEN

(Homo sapiens) 		PF00089
(Trypsin) 		4 GLU A 699
LYS A 556
VAL A 553
PRO A 551
 None
 1.32A 6fgdA-1qrzA:
undetectable		 6fgdA-1qrzA:
19.58
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.
1tme THEILER'S MURINE
ENCEPHALOMYELITIS
VIRUS (SUBUNIT VP1)
THEILER'S MURINE
ENCEPHALOMYELITIS
VIRUS (SUBUNIT VP2)

(Cardiovirus B;
Cardiovirus B) 		no annotation
PF00073
(Rhv) 		4 GLU 2 146
LYS 1 211
PHE 1 213
VAL 1 215
 None
 1.24A 6fgdA-1tme2:
undetectable		 6fgdA-1tme2:
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.
1ukw ACYL-COA
DEHYDROGENASE

(Thermus
thermophilus) 		PF00441
(Acyl-CoA_dh_1)
PF02770
(Acyl-CoA_dh_M)
PF02771
(Acyl-CoA_dh_N) 		4 GLU A 135
ARG A 139
VAL A 251
PRO A 250
 None
 1.32A 6fgdA-1ukwA:
undetectable		 6fgdA-1ukwA:
21.27
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.
1vyh PLATELET-ACTIVATING
FACTOR
ACETYLHYDROLASE IB
ALPHA SUBUNIT

(Mus musculus) 		PF00400
(WD40) 		4 LYS C 163
PHE C 158
VAL C 119
PRO C 118
 None
 1.48A 6fgdA-1vyhC:
undetectable		 6fgdA-1vyhC:
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.
1x0l HOMOISOCITRATE
DEHYDROGENASE

(Thermus
thermophilus) 		PF00180
(Iso_dh) 		4 GLU A 298
ARG A 103
VAL A 115
PRO A  99
 None
 1.04A 6fgdA-1x0lA:
5.8		 6fgdA-1x0lA:
22.87
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.
1xc6 BETA-GALACTOSIDASE

(Penicillium sp.) 		PF01301
(Glyco_hydro_35)
PF10435
(BetaGal_dom2)
PF13363
(BetaGal_dom3)
PF13364
(BetaGal_dom4_5) 		4 GLU A 858
ARG A1007
VAL A 852
PRO A1002
 None
None
None
IOD  A9066 ( 4.9A)
 1.47A 6fgdA-1xc6A:
undetectable		 6fgdA-1xc6A:
18.36
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.
2an2 P332G A333S DOUBLE
MUTANT OF NITRIC
OXIDE SYNTHASE FROM
BACILLUS SUBTILIS

(Bacillus
subtilis) 		PF02898
(NO_synthase) 		4 GLU A  17
ARG A  57
VAL A 221
PRO A 349
 None
 1.49A 6fgdA-2an2A:
undetectable		 6fgdA-2an2A:
22.17
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2bra NEDD9 INTERACTING
PROTEIN WITH
CALPONIN HOMOLOGY
AND LIM DOMAINS

(Mus musculus) 		PF01494
(FAD_binding_3) 		4 GLU A 350
ARG A 335
PHE A 351
PRO A 359
 None
 1.42A 6fgdA-2braA:
3.2		 6fgdA-2braA:
23.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2cxn GLUCOSE-6-PHOSPHATE
ISOMERASE

(Mus musculus) 		PF00342
(PGI) 		4 GLU A 460
ARG A 446
VAL A 467
PRO A 442
 None
 1.30A 6fgdA-2cxnA:
2.7		 6fgdA-2cxnA:
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.
2ece 462AA LONG
HYPOTHETICAL
SELENIUM-BINDING
PROTEIN

(Sulfurisphaera
tokodaii) 		PF05694
(SBP56) 		4 LYS A 314
PHE A 316
VAL A 319
PRO A 320
 None
 1.24A 6fgdA-2eceA:
undetectable		 6fgdA-2eceA:
24.24
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.
2h36 HYPOTHETICAL PROTEIN
SIFV0014

(Sulfolobus
islandicus
filamentous
virus) 		PF07118
(DUF1374) 		4 GLU X 102
LYS X  40
PHE X  41
PRO X  44
 None
 1.40A 6fgdA-2h36X:
2.6		 6fgdA-2h36X:
14.24
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.
2i6e HYPOTHETICAL PROTEIN

(Deinococcus
radiodurans) 		PF02621
(VitK2_biosynth) 		4 GLU A 121
ARG A 125
VAL A 279
PRO A 280
 None
 1.32A 6fgdA-2i6eA:
undetectable		 6fgdA-2i6eA:
22.95
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.
2inb HYPOTHETICAL PROTEIN

(Nostoc
punctiforme) 		PF08814
(XisH) 		4 GLU A  64
PHE A   7
VAL A  99
PRO A 100
 None
 1.30A 6fgdA-2inbA:
undetectable		 6fgdA-2inbA:
17.66
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2iuy GLYCOSYLTRANSFERASE

(Streptomyces
viridochromogenes) 		PF00534
(Glycos_transf_1) 		4 GLU A 270
ARG A 235
VAL A  34
PRO A  35
 None
 1.49A 6fgdA-2iuyA:
4.2		 6fgdA-2iuyA:
23.13
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.
2m9k RNA-BINDING PROTEIN
WITH MULTIPLE
SPLICING 2

(Homo sapiens) 		PF00076
(RRM_1) 		4 GLU A  46
LYS A  43
VAL A  40
PRO A  69
 None
 1.46A 6fgdA-2m9kA:
undetectable		 6fgdA-2m9kA:
11.41
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.
2q0x UNCHARACTERIZED
PROTEIN

(Trypanosoma
brucei) 		PF08538
(DUF1749) 		4 GLU A 109
ARG A 298
VAL A 225
PRO A 226
 None
 1.28A 6fgdA-2q0xA:
2.7		 6fgdA-2q0xA:
22.32
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2qdr UNCHARACTERIZED
PROTEIN

(Nostoc
punctiforme) 		PF14499
(DUF4437) 		4 GLU A 102
LYS A 146
PHE A 101
PRO A  98
 None
 1.46A 6fgdA-2qdrA:
undetectable		 6fgdA-2qdrA:
23.13
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.
2qvb HALOALKANE
DEHALOGENASE 3

(Mycobacterium
tuberculosis) 		PF00561
(Abhydrolase_1) 		4 GLU A 187
ARG A 181
PHE A   4
PRO A 280
 None
 1.42A 6fgdA-2qvbA:
2.0		 6fgdA-2qvbA:
22.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2rgy TRANSCRIPTIONAL
REGULATOR, LACI
FAMILY

(Paraburkholderia
phymatum) 		PF13377
(Peripla_BP_3) 		4 GLU A 346
PHE A 347
VAL A 349
PRO A 320
 None
 0.95A 6fgdA-2rgyA:
5.9		 6fgdA-2rgyA:
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.
2wjv REGULATOR OF
NONSENSE TRANSCRIPTS
1

(Homo sapiens) 		PF04851
(ResIII)
PF09416
(UPF1_Zn_bind)
PF13086
(AAA_11)
PF13087
(AAA_12) 		4 GLU A 718
ARG A 697
VAL A 689
PRO A 695
 None
 1.39A 6fgdA-2wjvA:
undetectable		 6fgdA-2wjvA:
20.78
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.
2xbz RETS-HYBRID SENSOR
KINASE

(Pseudomonas
aeruginosa) 		PF07696
(7TMR-DISMED2) 		4 GLU A  56
ARG A  54
PHE A  82
PRO A  83
 None
 1.05A 6fgdA-2xbzA:
undetectable		 6fgdA-2xbzA:
17.77
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.
2z6b BASEPLATE STRUCTURAL
PROTEIN GP27

(Escherichia
virus T4) 		PF09096
(Phage-tail_2)
PF09097
(Phage-tail_1) 		4 GLU D 294
ARG D 279
VAL D 157
PRO D 158
 None
 1.26A 6fgdA-2z6bD:
undetectable		 6fgdA-2z6bD:
21.74
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ax6 PHOSPHORIBOSYLAMINOI
MIDAZOLE
CARBOXYLASE, ATPASE
SUBUNIT

(Thermotoga
maritima) 		PF02222
(ATP-grasp) 		4 GLU A 257
PHE A 246
VAL A 115
PRO A 116
 None
ADP  A 381 (-4.8A)
None
None
 1.37A 6fgdA-3ax6A:
4.3		 6fgdA-3ax6A:
23.55
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.
3csw PUTATIVE
BRANCHED-CHAIN-AMINO
-ACID
AMINOTRANSFERASE

(Thermotoga
maritima) 		PF01063
(Aminotran_4) 		4 GLU A 216
ARG A 210
VAL A 170
PRO A 181
 None
 1.46A 6fgdA-3cswA:
undetectable		 6fgdA-3cswA:
22.76
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3emv URIDINE
PHOSPHORYLASE,
PUTATIVE

(Plasmodium
vivax) 		PF01048
(PNP_UDP_1) 		4 GLU A 185
ARG A  89
PHE A 204
VAL A 182
 None
SO4  A 254 (-3.2A)
None
None
 1.32A 6fgdA-3emvA:
3.6		 6fgdA-3emvA:
20.33
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.
3gsi N,N-DIMETHYLGLYCINE
OXIDASE

(Arthrobacter
globiformis) 		PF01266
(DAO)
PF01571
(GCV_T)
PF08669
(GCV_T_C)
PF16350
(FAO_M) 		4 ARG A 392
PHE A 393
VAL A 218
PRO A 219
 None
 1.43A 6fgdA-3gsiA:
3.8		 6fgdA-3gsiA:
18.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3gyr PHENOXAZINONE
SYNTHASE

(Streptomyces
antibioticus) 		PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3) 		4 GLU A 512
ARG A 441
PHE A 504
VAL A 618
 None
 1.23A 6fgdA-3gyrA:
undetectable		 6fgdA-3gyrA:
22.61
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.
3hbc CHOLOYLGLYCINE
HYDROLASE

(Bacteroides
thetaiotaomicron) 		PF02275
(CBAH) 		4 GLU A 295
ARG A 260
VAL A 252
PRO A 253
 None
 1.31A 6fgdA-3hbcA:
undetectable		 6fgdA-3hbcA:
21.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3hei EPHRIN TYPE-A
RECEPTOR 2
EPHRIN-A1

(Homo sapiens;
Homo sapiens) 		PF01404
(Ephrin_lbd)
PF00812
(Ephrin) 		4 GLU B 119
ARG A  76
PHE A  81
PRO A  82
 None
 1.15A 6fgdA-3heiB:
undetectable		 6fgdA-3heiB:
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.
3hhs PHENOLOXIDASE
SUBUNIT 1

(Manduca sexta) 		PF00372
(Hemocyanin_M)
PF03722
(Hemocyanin_N)
PF03723
(Hemocyanin_C) 		4 GLU B 418
ARG B 522
LYS B 649
PHE B 518
 None
 1.48A 6fgdA-3hhsB:
undetectable		 6fgdA-3hhsB:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3jyb SENSOR PROTEIN

(Pseudomonas
aeruginosa) 		PF07696
(7TMR-DISMED2) 		4 GLU A  56
ARG A  54
PHE A  82
PRO A  83
 None
 1.12A 6fgdA-3jybA:
undetectable		 6fgdA-3jybA:
16.59
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.
3koy D-ORNITHINE
AMINOMUTASE E
COMPONENT

(Acetoanaerobium
sticklandii) 		PF02310
(B12-binding)
PF09043
(Lys-AminoMut_A)
PF16554
(OAM_dimer) 		4 GLU A  88
ARG A 498
VAL A 130
PRO A 131
 None
 1.40A 6fgdA-3koyA:
undetectable		 6fgdA-3koyA:
19.58
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.
3kv6 JMJC
DOMAIN-CONTAINING
HISTONE
DEMETHYLATION
PROTEIN 1D

(Homo sapiens) 		PF00628
(PHD)
PF02373
(JmjC) 		4 GLU A 125
ARG A 129
PHE A 327
VAL A 326
 None
 1.41A 6fgdA-3kv6A:
undetectable		 6fgdA-3kv6A:
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.
3mmp ELONGATION FACTOR TU
2, ELONGATION FACTOR
TS

(Escherichia
coli) 		PF00009
(GTP_EFTU)
PF00889
(EF_TS)
PF03143
(GTP_EFTU_D3)
PF03144
(GTP_EFTU_D2) 		4 GLU A 262
ARG A 133
PHE A 258
VAL A 153
 None
 0.88A 6fgdA-3mmpA:
undetectable		 6fgdA-3mmpA:
21.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3n7k BOTULINUM NEUROTOXIN
TYPE C1

(Clostridium
botulinum) 		PF07951
(Toxin_R_bind_C)
PF07953
(Toxin_R_bind_N) 		4 ARG A 945
LYS A1006
VAL A1287
PRO A1288
 None
 1.47A 6fgdA-3n7kA:
undetectable		 6fgdA-3n7kA:
22.49
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.
3oyz MALATE SYNTHASE

(Haloferax
volcanii) 		PF03328
(HpcH_HpaI) 		4 GLU A  51
ARG A  84
VAL A 191
PRO A 231
 MG  A 500 ( 4.5A)
PYR  A 435 ( 3.2A)
PYR  A 435 (-3.5A)
PYR  A 435 (-4.1A)
 1.27A 6fgdA-3oyzA:
undetectable		 6fgdA-3oyzA:
22.95
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.
3rjt LIPOLYTIC PROTEIN
G-D-S-L FAMILY

(Alicyclobacillus
acidocaldarius) 		PF13472
(Lipase_GDSL_2) 		4 GLU A  73
ARG A 126
VAL A  84
PRO A  81
 None
 1.49A 6fgdA-3rjtA:
2.9		 6fgdA-3rjtA:
19.29
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.
3shq UBLCP1

(Drosophila
melanogaster) 		PF00240
(ubiquitin)
PF03031
(NIF) 		4 GLU A  33
ARG A  36
VAL A 121
PRO A 234
 None
 1.37A 6fgdA-3shqA:
undetectable		 6fgdA-3shqA:
23.18
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.
3tgw V-TYPE ATP SYNTHASE
BETA CHAIN

(Methanosarcina
mazei) 		PF00006
(ATP-synt_ab)
PF02874
(ATP-synt_ab_N) 		4 GLU A 331
ARG A 379
VAL A 327
PRO A 345
 None
 1.08A 6fgdA-3tgwA:
undetectable		 6fgdA-3tgwA:
24.16
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.
3umm PHOSPHORIBOSYLFORMYL
GLYCINAMIDINE
SYNTHASE

(Salmonella
enterica) 		PF02769
(AIRS_C)
PF13507
(GATase_5) 		4 GLU A1005
ARG A1168
VAL A 675
PRO A 676
 None
 1.30A 6fgdA-3ummA:
3.9		 6fgdA-3ummA:
16.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3w25 GLYCOSIDE HYDROLASE
FAMILY 10

(Thermoanaerobacterium
saccharolyticum) 		PF00331
(Glyco_hydro_10) 		4 GLU A 169
LYS A 170
PHE A 172
PRO A 214
 None
 1.39A 6fgdA-3w25A:
undetectable		 6fgdA-3w25A:
20.18
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.
3zd1 COMPLEMENT FACTOR
H-RELATED PROTEIN 2

(Homo sapiens) 		PF00084
(Sushi) 		4 GLU A 220
LYS A 204
PHE A 221
PRO A 247
 None
 1.45A 6fgdA-3zd1A:
undetectable		 6fgdA-3zd1A:
13.94
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.
3zk4 DIPHOSPHONUCLEOTIDE
PHOSPHATASE 1

(Lupinus luteus) 		PF00149
(Metallophos)
PF14008
(Metallophos_C)
PF16656
(Pur_ac_phosph_N) 		4 LYS A 254
PHE A 253
VAL A 338
PRO A 339
 None
 1.37A 6fgdA-3zk4A:
undetectable		 6fgdA-3zk4A:
20.46
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.
4ain GLYCINE BETAINE
TRANSPORTER BETP

(Corynebacterium
glutamicum) 		PF02028
(BCCT) 		4 GLU A 132
ARG A 390
PHE A 209
VAL A 211
 None
 1.28A 6fgdA-4ainA:
undetectable		 6fgdA-4ainA:
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.
4esp PROFILIN

(Arachis
hypogaea) 		PF00235
(Profilin) 		4 GLU A  46
LYS A  43
PHE A  42
PRO A  40
 None
None
EDO  A 207 (-3.8A)
None
 1.17A 6fgdA-4espA:
undetectable		 6fgdA-4espA:
15.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4evz HISF-LUCA

(synthetic
construct) 		PF00977
(His_biosynth) 		4 GLU A  64
ARG A  68
VAL A  12
PRO A  32
 None
 1.44A 6fgdA-4evzA:
undetectable		 6fgdA-4evzA:
23.37
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.
4fmc RORF2

(Escherichia
coli) 		PF06872
(EspG) 		4 GLU A 379
ARG A 382
VAL A 369
PRO A 370
 None
 1.38A 6fgdA-4fmcA:
undetectable		 6fgdA-4fmcA:
22.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4fwt ELONGATION FACTOR
TS, ELONGATION
FACTOR TU, LINKER, Q
BETA REPLICASE

(Escherichia
coli;
Escherichia
virus Qbeta) 		PF00009
(GTP_EFTU)
PF00889
(EF_TS)
PF03143
(GTP_EFTU_D3)
PF03144
(GTP_EFTU_D2)
PF03431
(RNA_replicase_B) 		4 GLU A 263
ARG A 134
PHE A 259
VAL A 154
 None
 1.08A 6fgdA-4fwtA:
undetectable		 6fgdA-4fwtA:
16.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4hhr ALPHA-DIOXYGENASE

(Arabidopsis
thaliana) 		PF03098
(An_peroxidase) 		4 GLU A 170
ARG A 266
VAL A 477
PRO A 465
 None
 1.28A 6fgdA-4hhrA:
undetectable		 6fgdA-4hhrA:
21.25
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.
4hzu ENERGY-COUPLING
FACTOR TRANSPORTER
TRANSMEMBRANE
PROTEIN ECFT

(Lactobacillus
brevis) 		PF02361
(CbiQ) 		4 GLU T 174
ARG T 215
PHE T 167
VAL T 168
 None
 1.47A 6fgdA-4hzuT:
undetectable		 6fgdA-4hzuT:
21.88
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.
4ic5 PROTEASE DO-LIKE 5,
CHLOROPLASTIC

(Arabidopsis
thaliana) 		PF13365
(Trypsin_2) 		4 GLU A  87
ARG A  90
PHE A 219
VAL A 235
 CA  A 402 (-2.6A)
None
None
None
 1.48A 6fgdA-4ic5A:
undetectable		 6fgdA-4ic5A:
21.18
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.
4ict CYTOCHROME P450 121

(Mycobacterium
tuberculosis) 		PF00067
(p450) 		4 GLU A 310
ARG A 387
VAL A   9
PRO A  10
 None
 1.40A 6fgdA-4ictA:
undetectable		 6fgdA-4ictA:
23.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4iug BETA-GALACTOSIDASE A

(Aspergillus
oryzae) 		PF01301
(Glyco_hydro_35)
PF10435
(BetaGal_dom2)
PF13363
(BetaGal_dom3)
PF13364
(BetaGal_dom4_5) 		4 GLU A 855
ARG A1001
VAL A 849
PRO A 996
 None
None
NAG  A1158 ( 4.1A)
None
 1.40A 6fgdA-4iugA:
undetectable		 6fgdA-4iugA:
17.83
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.
4lih GAMMA-GLUTAMYL-GAMMA
-AMINOBUTYRALDEHYDE
DEHYDROGENASE

(Burkholderia
cenocepacia) 		PF00171
(Aldedh) 		4 GLU A 105
LYS A 111
VAL A 344
PRO A  42
 None
 1.48A 6fgdA-4lihA:
3.5		 6fgdA-4lihA:
23.58
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.
4lj2 CHORISMATE SYNTHASE

(Acinetobacter
baumannii) 		PF01264
(Chorismate_synt) 		4 GLU A 333
ARG A  47
VAL A 173
PRO A 174
 None
 1.38A 6fgdA-4lj2A:
undetectable		 6fgdA-4lj2A:
22.94
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.
4pc7 ELONGATION FACTOR TS

(Escherichia
coli) 		PF00889
(EF_TS) 		4 GLU C 262
ARG C 133
PHE C 258
VAL C 153
 None
 0.97A 6fgdA-4pc7C:
undetectable		 6fgdA-4pc7C:
21.74
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4pj3 INTRON-BINDING
PROTEIN AQUARIUS

(Homo sapiens) 		PF13086
(AAA_11)
PF13087
(AAA_12)
PF16399
(Aquarius_N) 		4 ARG A 811
PHE A 751
VAL A 753
PRO A 752
 None
 1.32A 6fgdA-4pj3A:
undetectable		 6fgdA-4pj3A:
14.25
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.
4rxv HYPOTHETICAL PROTEIN
LPG0944

(Legionella
pneumophila) 		no annotation 4 ARG A  97
LYS A  19
PHE A  20
VAL A 174
 None
 0.91A 6fgdA-4rxvA:
undetectable		 6fgdA-4rxvA:
21.62
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.
4txv CYTOCHROME C OXIDASE
SUBUNIT 2

(Bradyrhizobium
diazoefficiens) 		PF00116
(COX2) 		4 GLU B 125
PHE B 123
VAL B 128
PRO B 129
 None
 1.48A 6fgdA-4txvB:
undetectable		 6fgdA-4txvB:
18.45
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4u90 GEPHYRIN

(Rattus
norvegicus) 		PF00994
(MoCF_biosynth)
PF03453
(MoeA_N)
PF03454
(MoeA_C) 		6 GLU A 343
ARG A 353
LYS A 497
PHE A 498
VAL A 500
PRO A 540
 None
 0.22A 6fgdA-4u90A:
50.7		 6fgdA-4u90A:
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.
4uoz BETA-GALACTOSIDASE

(Bifidobacterium
animalis) 		PF02449
(Glyco_hydro_42)
PF08532
(Glyco_hydro_42M)
PF08533
(Glyco_hydro_42C) 		4 GLU A 245
ARG A 136
PHE A 246
PRO A 130
 None
 1.50A 6fgdA-4uozA:
3.3		 6fgdA-4uozA:
19.66
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ync NADPH DEHYDROGENASE
1

(Saccharomyces
pastorianus) 		PF00724
(Oxidored_FMN) 		4 GLU A 273
ARG A 281
LYS A 317
VAL A 320
 None
 1.47A 6fgdA-4yncA:
undetectable		 6fgdA-4yncA:
23.70
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4z81 EGF FAMILY
DOMAIN-CONTAINING
PROTEIN

(Toxoplasma
gondii) 		PF02430
(AMA-1)
PF07974
(EGF_2) 		4 GLU A 393
ARG A  92
PHE A 305
VAL A 384
 None
 1.23A 6fgdA-4z81A:
undetectable		 6fgdA-4z81A:
21.22
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.
5c3o THYMINE DIOXYGENASE

(Neurospora
crassa) 		PF03171
(2OG-FeII_Oxy)
PF14226
(DIOX_N) 		4 GLU A 122
ARG A 190
PHE A 292
PRO A 295
 None
 1.23A 6fgdA-5c3oA:
undetectable		 6fgdA-5c3oA:
22.30
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.
5d88 PREDICTED PROTEASE
OF THE COLLAGENASE
FAMILY

(Methanopyrus
kandleri) 		PF01136
(Peptidase_U32) 		4 GLU A  45
ARG A  39
VAL A  26
PRO A  27
 None
 1.41A 6fgdA-5d88A:
undetectable		 6fgdA-5d88A:
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.
5gs6 NS1 OF ZIKA VIRUS
FROM 2015 BRAZIL
STRAIN

(Zika virus) 		PF00948
(Flavi_NS1) 		4 GLU A 205
ARG A 211
LYS A 213
PRO A 319
 None
NAG  A 601 (-3.4A)
None
None
 1.18A 6fgdA-5gs6A:
undetectable		 6fgdA-5gs6A:
22.25
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.
5gs6 NS1 OF ZIKA VIRUS
FROM 2015 BRAZIL
STRAIN

(Zika virus) 		PF00948
(Flavi_NS1) 		4 GLU A 205
ARG A 257
LYS A 213
PHE A 277
 None
 0.91A 6fgdA-5gs6A:
undetectable		 6fgdA-5gs6A:
22.25
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.
5gs6 NS1 OF ZIKA VIRUS
FROM 2015 BRAZIL
STRAIN

(Zika virus) 		PF00948
(Flavi_NS1) 		4 GLU A 205
LYS A 213
PHE A 277
PRO A 319
 None
 1.10A 6fgdA-5gs6A:
undetectable		 6fgdA-5gs6A:
22.25
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.
5gus HELIX-TURN-HELIX
DOMAIN-CONTAINING
PROTEIN

(Zymomonas
mobilis) 		PF04266
(ASCH) 		4 GLU A   9
ARG A  43
PHE A  58
VAL A  55
 None
 1.47A 6fgdA-5gusA:
undetectable		 6fgdA-5gusA:
17.44
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.
5hsi PUTATIVE
DECARBOXYLASE

(Lactobacillus
brevis) 		PF00282
(Pyridoxal_deC) 		4 GLU A 384
ARG A 313
PHE A 323
VAL A 292
 None
 1.39A 6fgdA-5hsiA:
3.9		 6fgdA-5hsiA:
21.09
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.
5ihr PROBABLE
BETA-GALACTOSIDASE A

(Aspergillus
niger) 		PF01301
(Glyco_hydro_35)
PF10435
(BetaGal_dom2)
PF13363
(BetaGal_dom3)
PF13364
(BetaGal_dom4_5) 		4 GLU A 855
ARG A1003
VAL A 849
PRO A 998
 None
 1.40A 6fgdA-5ihrA:
undetectable		 6fgdA-5ihrA:
18.72
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.
5iy3 GENOME POLYPROTEIN

(Zika virus) 		PF00948
(Flavi_NS1) 		4 GLU A 205
LYS A 213
PHE A 277
PRO A 319
 None
 1.16A 6fgdA-5iy3A:
undetectable		 6fgdA-5iy3A:
18.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5jla PUTATIVE SHORT-CHAIN
DEHYDROGENASE/REDUCT
ASE

(Paraburkholderia
xenovorans) 		PF13561
(adh_short_C2) 		4 GLU A   6
ARG A 231
PHE A 226
VAL A 224
 None
 1.28A 6fgdA-5jlaA:
undetectable		 6fgdA-5jlaA:
22.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5m60 BETA-1,3-GLUCANASE

(Chaetomium
thermophilum) 		PF12708
(Pectate_lyase_3) 		4 GLU A 568
LYS A 566
PHE A 570
VAL A 609
 None
 1.45A 6fgdA-5m60A:
undetectable		 6fgdA-5m60A:
20.53
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.
5m6g BETA-GLUCOSIDASE

(Saccharopolyspora
erythraea) 		no annotation 4 GLU A 384
ARG A  50
PHE A 378
PRO A 123
 None
 1.42A 6fgdA-5m6gA:
undetectable		 6fgdA-5m6gA:
23.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5mj7 UNCHARACTERIZED
PROTEIN

(Caenorhabditis
elegans) 		PF01156
(IU_nuc_hydro) 		4 LYS A 313
PHE A 314
VAL A 200
PRO A 201
 None
 1.17A 6fgdA-5mj7A:
2.5		 6fgdA-5mj7A:
21.08
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.
5mu3 CENTRAL KINETOCHORE
SUBUNIT MCM21

(Kluyveromyces
lactis) 		no annotation 4 GLU A 114
ARG A 138
PHE A 125
PRO A 126
 None
 1.25A 6fgdA-5mu3A:
undetectable		 6fgdA-5mu3A:
17.88
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.
5nzb PROFILIN-2

(Betula pendula) 		no annotation 4 GLU A  48
LYS A  45
PHE A  44
PRO A  42
 None
 1.09A 6fgdA-5nzbA:
undetectable		 6fgdA-5nzbA:
15.55
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ubp LEUCINE PERMEASE
TRANSCRIPTIONAL
REGULATOR

(Saccharomyces
cerevisiae) 		PF03399
(SAC3_GANP) 		4 GLU A 171
ARG A 168
PHE A 207
PRO A 205
 None
 1.42A 6fgdA-5ubpA:
undetectable		 6fgdA-5ubpA:
20.64
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.
5vip MDCD

(Pseudomonas
aeruginosa) 		PF01039
(Carboxyl_trans) 		4 GLU B 117
ARG B  21
PHE B  13
VAL B 175
 None
 1.46A 6fgdA-5vipB:
undetectable		 6fgdA-5vipB:
22.12
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.
5xdr PRE-MRNA-SPLICING
FACTOR ATP-DEPENDENT
RNA HELICASE DHX15

(Homo sapiens) 		PF00270
(DEAD)
PF00271
(Helicase_C)
PF04408
(HA2)
PF07717
(OB_NTP_bind) 		4 GLU A 224
ARG A 195
VAL A 596
PRO A 597
 None
 1.39A 6fgdA-5xdrA:
undetectable		 6fgdA-5xdrA:
22.49
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.
6bhc PSEUDOPODIUM-ENRICHE
D ATYPICAL KINASE 1

(Homo sapiens) 		no annotation 4 GLU A1465
ARG A1550
PHE A1385
VAL A1383
 None
 1.18A 6fgdA-6bhcA:
undetectable		 6fgdA-6bhcA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6cri


(;
) 		no annotation
no annotation 		4 GLU S  89
ARG S  86
VAL G 284
PRO G 243
 None
 1.42A 6fgdA-6criS:
undetectable		 6fgdA-6criS:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6fn0 -

(-) 		no annotation 4 GLU A 223
ARG A 270
PHE A 226
PRO A 229
 None
 1.48A 6fgdA-6fn0A:
2.5		 6fgdA-6fn0A:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6gu8 -

(-) 		no annotation 4 GLU A  59
ARG A  56
LYS A  41
PRO A  35
 None
 1.43A 6fgdA-6gu8A:
3.3		 6fgdA-6gu8A:
undetectable