SIMILAR PATTERNS OF AMINO ACIDS FOR 4IAR_A_ERMA2001_2

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.
1bpo PROTEIN (CLATHRIN)

(Rattus
norvegicus) 		PF01394
(Clathrin_propel)
PF09268
(Clathrin-link)
PF13838
(Clathrin_H_link) 		4 ILE A  40
THR A  29
PHE A 304
ASP A  35
 None
 0.99A 4iarA-1bpoA:
undetectable		 4iarA-1bpoA:
21.01
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.
1eg3 DYSTROPHIN

(Homo sapiens) 		PF00397
(WW)
PF09068
(EF-hand_2)
PF09069
(EF-hand_3) 		4 ILE A 151
THR A 155
VAL A  70
ASP A  84
 None
 1.10A 4iarA-1eg3A:
undetectable		 4iarA-1eg3A:
19.70
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.
1gll GLYCEROL KINASE

(Escherichia
coli) 		no annotation 4 ILE Y 313
THR Y 380
SER Y 329
ASP Y 409
 ACP  Y 601 (-3.9A)
None
ACP  Y 601 (-3.0A)
None
 1.18A 4iarA-1gllY:
undetectable		 4iarA-1gllY:
21.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1mco IGG1 MCG INTACT
ANTIBODY (HEAVY
CHAIN)

(Homo sapiens) 		PF07654
(C1-set)
PF07686
(V-set) 		4 ILE H  50
VAL H  94
SER H  37
PHE H  80
 None
 1.29A 4iarA-1mcoH:
undetectable		 4iarA-1mcoH:
22.29
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.
1o0x METHIONINE
AMINOPEPTIDASE

(Thermotoga
maritima) 		PF00557
(Peptidase_M24) 		4 ILE A  96
THR A 121
VAL A  80
ASP A 214
 None
 1.26A 4iarA-1o0xA:
undetectable		 4iarA-1o0xA:
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.
1p1m HYPOTHETICAL PROTEIN
TM0936

(Thermotoga
maritima) 		PF01979
(Amidohydro_1) 		4 ILE A 332
VAL A 342
PHE A  17
ASP A  41
 None
 1.37A 4iarA-1p1mA:
undetectable		 4iarA-1p1mA:
20.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1q5r PROTEASOME BETA-TYPE
SUBUNIT 1

(Rhodococcus
erythropolis) 		PF00227
(Proteasome) 		4 ILE H   3
THR H   1
VAL H 121
ASP H 124
 None
 0.90A 4iarA-1q5rH:
undetectable		 4iarA-1q5rH:
22.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1u5t VPS36P
DEFECTIVE IN
VACUOLAR PROTEIN
SORTING

(Saccharomyces
cerevisiae) 		PF04157
(EAP30) 		4 ILE B 435
THR B 528
VAL B 478
ASP B 493
 None
 1.23A 4iarA-1u5tB:
undetectable		 4iarA-1u5tB:
17.28
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.
1vpl ABC TRANSPORTER,
ATP-BINDING PROTEIN

(Thermotoga
maritima) 		PF00005
(ABC_tran) 		4 ILE A 212
THR A 215
PHE A  32
ASP A 159
 None
 1.17A 4iarA-1vplA:
undetectable		 4iarA-1vplA:
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.
1wy0 GERANYLGERANYL
PYROPHOSPHATE
SYNTHETASE

(Pyrococcus
horikoshii) 		PF00348
(polyprenyl_synt) 		4 ILE A 246
THR A 244
PHE A 266
ASP A 255
 None
 1.09A 4iarA-1wy0A:
4.0		 4iarA-1wy0A:
21.84
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.
1ypf GMP REDUCTASE

(Bacillus
anthracis) 		PF00478
(IMPDH) 		4 ILE A  53
VAL A  41
SER A 239
ASP A 118
 None
 1.26A 4iarA-1ypfA:
undetectable		 4iarA-1ypfA:
20.43
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.
1zao RIO2 SERINE KINASE

(Archaeoglobus
fulgidus) 		PF01163
(RIO1)
PF09202
(Rio2_N) 		4 ILE A 148
VAL A 124
SER A  81
ASP A 235
 None
None
None
ATP  A 286 ( 2.5A)
 1.20A 4iarA-1zaoA:
undetectable		 4iarA-1zaoA:
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.
2h88 SUCCINATE
DEHYDROGENASE
FLAVOPROTEIN SUBUNIT

(Gallus gallus) 		PF00890
(FAD_binding_2)
PF02910
(Succ_DH_flav_C) 		4 ILE A 257
THR A 343
VAL A 321
ASP A 293
 None
 1.39A 4iarA-2h88A:
3.5		 4iarA-2h88A:
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.
2jyz CG7054-PA

(Drosophila
melanogaster) 		PF01161
(PBP) 		4 ILE A 131
THR A 128
VAL A 101
PHE A 147
 None
 1.20A 4iarA-2jyzA:
undetectable		 4iarA-2jyzA:
17.09
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.
2o62 HYPOTHETICAL PROTEIN

(Nostoc
punctiforme) 		PF12204
(DUF3598) 		4 TRP A 238
ILE A 122
THR A 120
VAL A  98
 None
 1.29A 4iarA-2o62A:
undetectable		 4iarA-2o62A:
19.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2okx RHAMNOSIDASE B

(Bacillus sp.
GL1) 		PF05592
(Bac_rhamnosid)
PF08531
(Bac_rhamnosid_N)
PF17389
(Bac_rhamnosid6H)
PF17390
(Bac_rhamnosid_C) 		4 TRP A 684
ILE A 687
THR A 766
ASP A 616
 None
 1.12A 4iarA-2okxA:
2.7		 4iarA-2okxA:
19.03
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.
2qgy ENOLASE FROM THE
ENVIRONMENTAL GENOME
SHOTGUN SEQUENCING
OF THE SARGASSO SEA

(-) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		4 ILE A  36
THR A  19
VAL A 361
SER A 304
 None
 1.16A 4iarA-2qgyA:
undetectable		 4iarA-2qgyA:
22.82
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.
2uu7 GLUTAMINE SYNTHETASE

(Canis lupus) 		PF00120
(Gln-synt_C)
PF03951
(Gln-synt_N) 		4 ILE A  33
THR A 111
VAL A 220
ASP A 213
 None
 1.36A 4iarA-2uu7A:
undetectable		 4iarA-2uu7A:
19.91
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.
2vhh CG3027-PA

(Drosophila
melanogaster) 		PF00795
(CN_hydrolase) 		4 ILE A  82
THR A  86
VAL A 101
PHE A 139
 None
 1.13A 4iarA-2vhhA:
undetectable		 4iarA-2vhhA:
18.78
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.
2zkt 2,3-BISPHOSPHOGLYCER
ATE-INDEPENDENT
PHOSPHOGLYCERATE
MUTASE

(Pyrococcus
horikoshii) 		PF01676
(Metalloenzyme)
PF10143
(PhosphMutase) 		4 ILE A 234
THR A  75
PHE A  82
ASP A  90
 None
 1.09A 4iarA-2zktA:
undetectable		 4iarA-2zktA:
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.
3ayx MEMBRANE-BOUND
HYDROGENASE SMALL
SUBUNIT

(Hydrogenovibrio
marinus) 		PF01058
(Oxidored_q6)
PF14720
(NiFe_hyd_SSU_C) 		4 ILE B  78
THR B  13
VAL B  81
ASP B  52
 None
 1.15A 4iarA-3ayxB:
undetectable		 4iarA-3ayxB:
22.41
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.
3cob KINESIN HEAVY
CHAIN-LIKE PROTEIN

(Solanum
tuberosum) 		PF00225
(Kinesin) 		4 ILE A 980
THR A 990
VAL A1185
ASP A 935
 None
 1.29A 4iarA-3cobA:
undetectable		 4iarA-3cobA:
19.46
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.
3e9d ZGC:56074

(Danio rerio) 		PF00300
(His_Phos_1) 		4 ILE A   8
SER A 182
PHE A 135
ASP A 197
 None
 1.39A 4iarA-3e9dA:
undetectable		 4iarA-3e9dA:
19.60
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.
3efm FERRIC ALCALIGIN
SIDEROPHORE RECEPTOR

(Bordetella
pertussis) 		PF00593
(TonB_dep_Rec)
PF07715
(Plug) 		4 ILE A 111
THR A 120
PHE A 104
ASP A 311
 None
 1.34A 4iarA-3efmA:
undetectable		 4iarA-3efmA:
20.30
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3i3a ACYL-[ACYL-CARRIER-P
ROTEIN]--UDP-N-ACETY
LGLUCOSAMINE
O-ACYLTRANSFERASE

(Leptospira
interrogans) 		PF00132
(Hexapep)
PF13720
(Acetyltransf_11) 		4 THR A 256
VAL A 216
SER A 180
ASP A 229
 None
 1.37A 4iarA-3i3aA:
undetectable		 4iarA-3i3aA:
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.
3ivr PUTATIVE
LONG-CHAIN-FATTY-ACI
D COA LIGASE

(Rhodopseudomonas
palustris) 		PF00501
(AMP-binding) 		4 ILE A 188
VAL A 358
SER A 192
PHE A 329
 GOL  A 511 ( 4.3A)
None
None
None
 1.22A 4iarA-3ivrA:
undetectable		 4iarA-3ivrA:
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.
3j97 VESICLE-FUSING
ATPASE

(Cricetulus
griseus) 		PF00004
(AAA)
PF02359
(CDC48_N)
PF02933
(CDC48_2) 		4 THR A 534
VAL A 628
SER A 662
ASP A 590
 None
 1.29A 4iarA-3j97A:
undetectable		 4iarA-3j97A:
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.
3kw7 LACCASE B

(Trametes sp.
AH28-2) 		PF00394
(Cu-oxidase)
PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3) 		4 ILE A 386
THR A 433
VAL A 392
PHE A 466
 None
 1.27A 4iarA-3kw7A:
undetectable		 4iarA-3kw7A:
24.29
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.
3lzk FUMARYLACETOACETATE
HYDROLASE FAMILY
PROTEIN

(Sinorhizobium
meliloti) 		PF01557
(FAA_hydrolase) 		4 ILE A 177
VAL A  91
SER A 172
PHE A 305
 None
 1.21A 4iarA-3lzkA:
undetectable		 4iarA-3lzkA:
21.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3noj 4-CARBOXY-4-HYDROXY-
2-OXOADIPATE
ALDOLASE/OXALOACETAT
E DECARBOXYLASE

(Pseudomonas
putida) 		PF03737
(RraA-like) 		4 ILE A 164
THR A  63
SER A  90
ASP A 173
 None
 1.29A 4iarA-3nojA:
undetectable		 4iarA-3nojA:
21.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3o60 LIN0861 PROTEIN

(Listeria
innocua) 		no annotation 4 ILE A  97
THR A 100
PHE A 108
ASP A 122
 None
 1.39A 4iarA-3o60A:
undetectable		 4iarA-3o60A:
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.
3ogr BETA-GALACTOSIDASE

(Trichoderma
reesei) 		PF01301
(Glyco_hydro_35)
PF10435
(BetaGal_dom2)
PF13363
(BetaGal_dom3)
PF13364
(BetaGal_dom4_5) 		4 ILE A 539
THR A 541
VAL A 559
PHE A 521
 None
 0.89A 4iarA-3ogrA:
undetectable		 4iarA-3ogrA:
17.56
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.
3p54 ENVELOPE
GLYCOPROTEIN

(Japanese
encephalitis
virus) 		PF00869
(Flavi_glycoprot)
PF02832
(Flavi_glycop_C) 		4 ILE A  33
THR A  40
VAL A  24
ASP A  28
 None
 1.18A 4iarA-3p54A:
undetectable		 4iarA-3p54A:
22.22
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3pds FUSION PROTEIN
BETA-2 ADRENERGIC
RECEPTOR/LYSOZYME

(Escherichia
virus T4;
Homo sapiens) 		PF00001
(7tm_1)
PF00959
(Phage_lysozyme) 		4 TRP A 109
THR A 118
SER A 203
PHE A 290
 None
None
ERC  A1201 (-2.8A)
ERC  A1201 (-4.8A)
 0.57A 4iarA-3pdsA:
29.2		 4iarA-3pdsA:
30.62
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.
3rva ORGANOPHOSPHORUS
ACID ANHYDROLASE

(Alteromonas
macleodii) 		PF00557
(Peptidase_M24) 		4 ILE A 422
THR A 259
VAL A 286
ASP A 439
 None
 1.39A 4iarA-3rvaA:
undetectable		 4iarA-3rvaA:
23.81
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.
3sbg PRE-MRNA-SPLICING
FACTOR 8

(Saccharomyces
cerevisiae) 		PF08084
(PROCT)
PF12134
(PRP8_domainIV) 		4 ILE A2259
VAL A2184
PHE A2349
ASP A2343
 None
 1.06A 4iarA-3sbgA:
undetectable		 4iarA-3sbgA:
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.
3sfz APOPTOTIC PEPTIDASE
ACTIVATING FACTOR 1

(Mus musculus) 		PF00400
(WD40)
PF00931
(NB-ARC)
PF12894
(ANAPC4_WD40) 		4 TRP A1070
ILE A1019
THR A1012
VAL A1026
 None
 1.39A 4iarA-3sfzA:
undetectable		 4iarA-3sfzA:
15.47
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.
3sqz PUTATIVE
HYDROXYMETHYLGLUTARY
L-COA SYNTHASE

(Streptococcus
mutans) 		PF00195
(Chal_sti_synt_N)
PF08540
(HMG_CoA_synt_C) 		4 ILE A  62
VAL A 162
SER A  58
ASP A  72
 None
 0.84A 4iarA-3sqzA:
undetectable		 4iarA-3sqzA:
21.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3tkt CYTOCHROME P450

(Novosphingobium
aromaticivorans) 		PF00067
(p450) 		4 ILE A  16
THR A 415
VAL A  44
ASP A 338
 None
 0.86A 4iarA-3tktA:
undetectable		 4iarA-3tktA:
22.45
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3usz EXO-1,3/1,4-BETA-GLU
CANASE

(Pseudoalteromonas
sp. BB1) 		PF00933
(Glyco_hydro_3)
PF01915
(Glyco_hydro_3_C) 		4 ILE A 127
THR A 173
VAL A 393
SER A 530
 None
 1.38A 4iarA-3uszA:
undetectable		 4iarA-3uszA:
18.30
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.
4au7 HISTONE-LYSINE
N-METHYLTRANSFERASE
SUV420H2

(Mus musculus) 		PF00856
(SET) 		4 TRP A 174
ILE A 181
VAL A 192
PHE A 106
 None
 1.28A 4iarA-4au7A:
undetectable		 4iarA-4au7A:
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.
4bgd PRE-MRNA-SPLICING
FACTOR 8

(Saccharomyces
cerevisiae) 		PF08084
(PROCT) 		4 ILE C2259
VAL C2184
PHE C2349
ASP C2343
 None
 1.14A 4iarA-4bgdC:
undetectable		 4iarA-4bgdC:
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.
4d0k A-SPECIFIC
RIBONUCLEASE SUBUNIT
PAN2

(Chaetomium
thermophilum) 		no annotation 4 ILE A 299
THR A 257
VAL A   8
ASP A   4
 None
 1.28A 4iarA-4d0kA:
undetectable		 4iarA-4d0kA:
21.33
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.
4frz KINESIN-LIKE
CALMODULIN-BINDING
PROTEIN

(Arabidopsis
thaliana) 		PF00225
(Kinesin) 		4 ILE A 980
THR A 990
VAL A1185
ASP A 935
 None
 1.30A 4iarA-4frzA:
undetectable		 4iarA-4frzA:
20.91
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.
4gbr BETA-2 ADRENERGIC
RECEPTOR

(Homo sapiens) 		PF00001
(7tm_1) 		4 TRP A 109
THR A 118
SER A 203
PHE A 262
 None
CAU  A 500 ( 4.7A)
CAU  A 500 (-3.3A)
CAU  A 500 (-4.6A)
 0.76A 4iarA-4gbrA:
29.5		 4iarA-4gbrA:
29.83
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.
4h63 MEDIATOR OF RNA
POLYMERASE II
TRANSCRIPTION
SUBUNIT 11
MEDIATOR OF RNA
POLYMERASE II
TRANSCRIPTION
SUBUNIT 17
MEDIATOR OF RNA
POLYMERASE II
TRANSCRIPTION
SUBUNIT 22

(Schizosaccharomyces
pombe) 		PF06179
(Med22)
PF10156
(Med17)
no annotation 		4 THR K  64
VAL Q 197
SER K  36
ASP V  72
 None
 1.40A 4iarA-4h63K:
3.7		 4iarA-4h63K:
14.14
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.
4hf7 PUTATIVE
ACYLHYDROLASE

(Bacteroides
thetaiotaomicron) 		PF13472
(Lipase_GDSL_2) 		4 ILE A  63
THR A 115
VAL A  68
PHE A  93
 OSE  A  62 ( 4.3A)
OSE  A  62 ( 4.4A)
None
None
 1.04A 4iarA-4hf7A:
undetectable		 4iarA-4hf7A:
19.14
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4ib4 CHIMERA PROTEIN OF
HUMAN
5-HYDROXYTRYPTAMINE
RECEPTOR 2B AND E.
COLI SOLUBLE
CYTOCHROME B562

(Escherichia
coli;
Homo sapiens) 		PF00001
(7tm_1)
PF07361
(Cytochrom_B562) 		4 TRP A 131
THR A 140
VAL A 208
PHE A 341
 None
ERM  A2001 (-3.9A)
ERM  A2001 (-4.0A)
None
 0.52A 4iarA-4ib4A:
33.2		 4iarA-4ib4A:
49.54
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.
4iiv 3-OXOACYL-[ACYL-CARR
IER PROTEIN]
REDUCTASE

(Escherichia
coli) 		PF13561
(adh_short_C2) 		4 ILE A 160
THR A 164
VAL A 107
SER A  86
 None
 1.31A 4iarA-4iivA:
undetectable		 4iarA-4iivA:
20.29
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.
4iyj GDSL-LIKE PROTEIN

(Bacteroides
uniformis) 		PF13472
(Lipase_GDSL_2) 		4 ILE A  55
THR A 107
VAL A  60
PHE A  85
 UNL  A 301 ( 4.8A)
UNL  A 301 ( 3.8A)
None
None
 1.02A 4iarA-4iyjA:
undetectable		 4iarA-4iyjA:
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.
4j3c RIBOSOMAL RNA SMALL
SUBUNIT
METHYLTRANSFERASE E

(Sinorhizobium
meliloti) 		PF04452
(Methyltrans_RNA) 		4 ILE A 237
THR A 240
VAL A  84
ASP A 163
 None
 1.39A 4iarA-4j3cA:
undetectable		 4iarA-4j3cA:
21.87
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.
4jlc SERINE/THREONINE-PRO
TEIN KINASE TBK1

(Mus musculus) 		PF00069
(Pkinase) 		4 TRP A 205
ILE A 246
THR A 278
ASP A 288
 None
 1.40A 4iarA-4jlcA:
2.5		 4iarA-4jlcA:
19.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4kpr THIOREDOXIN
REDUCTASE 1,
CYTOPLASMIC

(Rattus
norvegicus) 		no annotation 4 ILE E 478
THR E 480
PHE E 452
ASP E 229
 None
 1.10A 4iarA-4kprE:
undetectable		 4iarA-4kprE:
22.24
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.
4lde LYSOZYME, BETA-2
ADRENERGIC RECEPTOR

(Escherichia
virus T4;
Homo sapiens) 		PF00001
(7tm_1)
PF00959
(Phage_lysozyme) 		4 TRP A1109
THR A1118
SER A1203
PHE A1290
 None
None
P0G  A1401 (-2.9A)
P0G  A1401 ( 4.9A)
 0.45A 4iarA-4ldeA:
30.3		 4iarA-4ldeA:
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.
4le5 S-ADENOSYLMETHIONINE
SYNTHETASE

(Campylobacter
jejuni) 		PF00438
(S-AdoMet_synt_N)
PF02772
(S-AdoMet_synt_M)
PF02773
(S-AdoMet_synt_C) 		4 ILE A  20
VAL A   9
SER A 275
ASP A 250
 None
 1.39A 4iarA-4le5A:
undetectable		 4iarA-4le5A:
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.
4o6d NS1

(West Nile virus) 		PF00948
(Flavi_NS1) 		4 ILE B 308
THR B 302
VAL B 285
ASP B 278
 None
 1.21A 4iarA-4o6dB:
undetectable		 4iarA-4o6dB:
19.07
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.
4oie NON-STRUCTURAL
PROTEIN NS1

(West Nile virus) 		PF00948
(Flavi_NS1) 		4 ILE A 308
THR A 302
VAL A 285
ASP A 278
 None
 1.20A 4iarA-4oieA:
undetectable		 4iarA-4oieA:
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.
4p0d TRYPSIN-RESISTANT
SURFACE T6 PROTEIN

(Streptococcus
pyogenes) 		PF16569
(GramPos_pilinBB) 		4 ILE A 380
THR A 394
SER A 198
PHE A 463
 None
 1.35A 4iarA-4p0dA:
undetectable		 4iarA-4p0dA:
21.67
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.
4pd4 CYTOCHROME B

(Saccharomyces
cerevisiae) 		PF00032
(Cytochrom_B_C)
PF00033
(Cytochrome_B) 		4 THR C 148
VAL C 264
SER C 170
ASP C 255
 None
 1.16A 4iarA-4pd4C:
4.0		 4iarA-4pd4C:
23.52
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.
4plf LACTATE
DEHYDROGENASE

(Apicomplexa) 		PF00056
(Ldh_1_N)
PF02866
(Ldh_1_C) 		4 THR A 225
VAL A 281
SER A 160
ASP A 309
 None
 1.21A 4iarA-4plfA:
undetectable		 4iarA-4plfA:
22.01
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.
4plh MALATE DEHYDROGENASE

(Apicomplexa) 		PF00056
(Ldh_1_N)
PF02866
(Ldh_1_C) 		4 THR A 216
VAL A 272
SER A 151
ASP A 300
 None
 1.25A 4iarA-4plhA:
undetectable		 4iarA-4plhA:
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.
4psp ALPHA-FUCOSIDASE
GH29

(Fusarium
graminearum) 		PF01120
(Alpha_L_fucos)
PF16757
(Fucosidase_C) 		4 TRP A 311
ILE A 343
PHE A  29
ASP A 286
 GOL  A 622 ( 2.8A)
None
None
None
 1.33A 4iarA-4pspA:
undetectable		 4iarA-4pspA:
20.26
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.
4puf E3 UBIQUITIN-PROTEIN
LIGASE SLRP

(Salmonella
enterica) 		PF12468
(TTSSLRR)
PF14496
(NEL) 		4 ILE A 538
THR A 534
VAL A 550
ASP A 501
 None
 1.14A 4iarA-4pufA:
undetectable		 4iarA-4pufA:
19.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4r6k SOLUTE-BINDING
PROTEIN

(Bacillus
subtilis) 		PF13416
(SBP_bac_8) 		4 ILE A 318
VAL A 326
PHE A 304
ASP A 101
 None
 1.06A 4iarA-4r6kA:
undetectable		 4iarA-4r6kA:
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.
4uri CHITINASE-RELATED
AGGLUTININ

(Robinia
pseudoacacia) 		PF00704
(Glyco_hydro_18) 		4 ILE A  70
VAL A  81
SER A  99
ASP A 123
 None
 1.40A 4iarA-4uriA:
undetectable		 4iarA-4uriA:
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.
4wa8 FLAP ENDONUCLEASE 1

(Methanopyrus
kandleri) 		PF00752
(XPG_N)
PF00867
(XPG_I) 		4 ILE A  27
THR A 186
VAL A 144
ASP A 137
 None
 1.39A 4iarA-4wa8A:
undetectable		 4iarA-4wa8A:
21.32
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.
4wat PFRH5

(Plasmodium
falciparum) 		no annotation 4 ILE A 157
VAL A 174
SER A 153
ASP A 218
 None
 1.14A 4iarA-4watA:
1.6		 4iarA-4watA:
19.14
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.
4wia PUTATIVE
FLAGELLA-RELATED
PROTEIN H

(Methanocaldococcus
jannaschii) 		PF06745
(ATPase) 		4 ILE A  32
THR A 186
PHE A 217
ASP A  17
 None
None
None
GOL  A 306 (-3.3A)
 1.33A 4iarA-4wiaA:
undetectable		 4iarA-4wiaA:
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.
5ah1 TRIACYLGLYCEROL
LIPASE

(Clostridium
botulinum) 		no annotation 4 ILE A 227
THR A 333
VAL A 224
ASP A 401
 None
 1.21A 4iarA-5ah1A:
undetectable		 4iarA-5ah1A:
20.66
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.
5c92 KELCH
DOMAIN-CONTAINING
PROTEIN

(Colletotrichum
graminicola) 		PF01344
(Kelch_1)
PF09118
(DUF1929) 		4 TRP A 184
ILE A 457
THR A 125
VAL A 232
 None
 1.35A 4iarA-5c92A:
undetectable		 4iarA-5c92A:
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.
5e0n ENOYL-COA
HYDRATASE/ISOMERASE

(Mycolicibacterium
smegmatis) 		PF00378
(ECH_1) 		4 ILE X 132
THR X 192
VAL X 109
PHE X 139
 None
 1.27A 4iarA-5e0nX:
undetectable		 4iarA-5e0nX:
22.86
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5f8u BETA-1 ADRENERGIC
RECEPTOR

(Meleagris
gallopavo) 		no annotation 4 TRP B 117
THR B 126
SER B 211
PHE B 307
 P32  B 400 (-4.8A)
None
P32  B 400 (-2.7A)
P32  B 400 (-4.9A)
 0.58A 4iarA-5f8uB:
30.5		 4iarA-5f8uB:
31.19
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.
5fa1 PUTATIVE N-ACETYL
GLUCOSAMINYL
TRANSFERASE

(Raoultella
terrigena) 		PF05159
(Capsule_synth) 		4 ILE A 298
THR A 243
VAL A 302
ASP A 280
 None
 1.39A 4iarA-5fa1A:
undetectable		 4iarA-5fa1A:
23.74
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.
5fwj HISTONE DEMETHYLASE
JARID1C

(Homo sapiens) 		PF02373
(JmjC)
PF02375
(JmjN)
PF02928
(zf-C5HC2) 		4 ILE A  69
THR A 389
VAL A 436
ASP A 407
 None
 1.20A 4iarA-5fwjA:
undetectable		 4iarA-5fwjA:
21.59
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.
5gsl 778AA LONG
HYPOTHETICAL
BETA-GALACTOSIDASE

(Pyrococcus
horikoshii) 		PF02449
(Glyco_hydro_42) 		4 ILE A 375
THR A 331
VAL A  21
ASP A   9
 None
 1.41A 4iarA-5gslA:
undetectable		 4iarA-5gslA:
18.57
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.
5hz1 PROBABLE LRR
RECEPTOR-LIKE
SERINE/THREONINE-PRO
TEIN KINASE
AT4G26540

(Arabidopsis
thaliana) 		PF13855
(LRR_8) 		4 ILE B 370
VAL B 343
PHE B 387
ASP B 316
 None
 1.24A 4iarA-5hz1B:
undetectable		 4iarA-5hz1B:
21.04
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.
5ilg PHOTORECEPTOR
DEHYDROGENASE,
ISOFORM C

(Drosophila
melanogaster) 		PF00106
(adh_short) 		4 ILE A 157
THR A 179
VAL A 105
ASP A  37
 None
None
NAD  A 302 (-3.9A)
NAD  A 302 ( 2.9A)
 1.15A 4iarA-5ilgA:
undetectable		 4iarA-5ilgA:
18.54
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.
5jen ANTI-SIGMA-V FACTOR
RSIV

(Bacillus
subtilis) 		PF11738
(DUF3298)
PF13739
(DUF4163) 		4 ILE A 250
THR A 239
VAL A 200
ASP A 194
 None
NA  A 400 (-3.2A)
None
None
 1.27A 4iarA-5jenA:
undetectable		 4iarA-5jenA:
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.
5ju6 BETA-GLUCOSIDASE

(Rasamsonia
emersonii) 		PF00933
(Glyco_hydro_3)
PF01915
(Glyco_hydro_3_C)
PF14310
(Fn3-like) 		4 ILE A 176
VAL A 144
PHE A 270
ASP A 277
 None
None
None
BGC  A 946 (-2.8A)
 1.15A 4iarA-5ju6A:
undetectable		 4iarA-5ju6A:
18.50
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.
5l94 CYTOCHROME P450

(Bacillus
megaterium) 		PF00067
(p450) 		4 ILE A 251
THR A 254
VAL A 144
ASP A 166
 None
 1.17A 4iarA-5l94A:
undetectable		 4iarA-5l94A:
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.
5nbs BETA-GLUCOSIDASE

(Neurospora
crassa) 		no annotation 4 ILE A 172
VAL A 140
PHE A 269
ASP A 276
 None
 1.14A 4iarA-5nbsA:
undetectable		 4iarA-5nbsA:
13.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5o19 GENOME POLYPROTEIN

(Japanese
encephalitis
virus) 		no annotation 4 ILE A 308
THR A 302
VAL A 285
ASP A 278
 None
SO4  A 401 (-3.3A)
None
None
 1.28A 4iarA-5o19A:
undetectable		 4iarA-5o19A:
12.47
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.
5o36 JAPANESE
ENCEPHALITIS VIRUS
NON-STRUCTURAL
PROTEIN 1'
(NS1'),JAPANESE
ENCEPHALITIS VIRUS
NON-STRUCTURAL
PROTEIN 1' (NS1')

(Japanese
encephalitis
virus) 		no annotation 4 ILE A 308
THR A 302
VAL A 285
ASP A 278
 None
SO4  A 503 (-3.0A)
None
None
 1.29A 4iarA-5o36A:
undetectable		 4iarA-5o36A:
12.47
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.
5svc ACETONE CARBOXYLASE
ALPHA SUBUNIT

(Xanthobacter
autotrophicus) 		PF02538
(Hydantoinase_B) 		4 THR A 314
SER A 338
PHE A 403
ASP A 545
 None
 1.37A 4iarA-5svcA:
undetectable		 4iarA-5svcA:
19.14
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.
5v12 HERCYNYLCYSTEINE
SULFOXIDE LYASE

(Neurospora
crassa) 		no annotation 4 ILE C 268
THR C 112
VAL C 262
ASP C 237
 None
 1.12A 4iarA-5v12C:
undetectable		 4iarA-5v12C:
12.90
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5v54 5-HYDROXYTRYPTAMINE
RECEPTOR 1B,OB-1
FUSED 5-HT1B
RECEPTOR,5-HYDROXYTR
YPTAMINE RECEPTOR 1B

(Homo sapiens;
Spodoptera
frugiperda) 		no annotation 5 TRP A 125
ILE A 130
SER A 212
PHE A 331
ASP A 352
 None
89F  A1201 (-4.3A)
89F  A1201 ( 3.8A)
89F  A1201 (-4.6A)
None
 0.58A 4iarA-5v54A:
41.3		 4iarA-5v54A:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5v54 5-HYDROXYTRYPTAMINE
RECEPTOR 1B,OB-1
FUSED 5-HT1B
RECEPTOR,5-HYDROXYTR
YPTAMINE RECEPTOR 1B

(Homo sapiens;
Spodoptera
frugiperda) 		no annotation 5 TRP A 125
ILE A 130
THR A 134
SER A 212
ASP A 352
 None
89F  A1201 (-4.3A)
89F  A1201 (-4.2A)
89F  A1201 ( 3.8A)
None
 0.47A 4iarA-5v54A:
41.3		 4iarA-5v54A:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5v54 5-HYDROXYTRYPTAMINE
RECEPTOR 1B,OB-1
FUSED 5-HT1B
RECEPTOR,5-HYDROXYTR
YPTAMINE RECEPTOR 1B

(Homo sapiens;
Spodoptera
frugiperda) 		no annotation 5 TRP A 125
ILE A 130
THR A 134
VAL A 200
SER A 212
 None
89F  A1201 (-4.3A)
89F  A1201 (-4.2A)
None
89F  A1201 ( 3.8A)
 0.64A 4iarA-5v54A:
41.3		 4iarA-5v54A:
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.
5w0x TIP41-LIKE PROTEIN

(Mus musculus) 		no annotation 4 ILE A  65
VAL A  54
PHE A 179
ASP A  12
 None
 1.24A 4iarA-5w0xA:
undetectable		 4iarA-5w0xA:
11.17
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.
5x55 PROBABLE URACIL-DNA
GLYCOSYLASE

(Acanthamoeba
polyphaga
mimivirus) 		PF03167
(UDG) 		4 ILE A 254
THR A 276
VAL A 177
PHE A 137
 None
 1.34A 4iarA-5x55A:
undetectable		 4iarA-5x55A:
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.
5xbf HARMONIN
UNCONVENTIONAL
MYOSIN-VIIB

(Homo sapiens) 		PF00373
(FERM_M)
PF00595
(PDZ)
PF00784
(MyTH4) 		4 ILE A2038
THR A2006
VAL A2025
ASP B 547
 None
 1.03A 4iarA-5xbfA:
undetectable		 4iarA-5xbfA:
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.
5y83 MEMBRANE PROTEIN
INSERTASE YIDC

(Thermotoga
maritima) 		no annotation 4 ILE A 118
THR A  37
VAL A 128
PHE A  54
 None
 1.30A 4iarA-5y83A:
undetectable		 4iarA-5y83A:
12.47
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.
5ywp JEV E PROTEIN

(Japanese
encephalitis
virus) 		no annotation 4 ILE A  33
THR A  40
VAL A  24
ASP A  28
 None
 1.16A 4iarA-5ywpA:
undetectable		 4iarA-5ywpA:
13.42
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.
5zq4 SIDE

(Legionella
pneumophila) 		no annotation 4 ILE B 325
THR B 236
VAL B 399
PHE B 229
 None
 1.32A 4iarA-5zq4B:
undetectable		 4iarA-5zq4B:
10.83
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.
6bqh 5-HYDROXYTRYPTAMINE
RECEPTOR 2C,SOLUBLE
CYTOCHROME B562

(Escherichia
coli;
Homo sapiens) 		no annotation 4 TRP A 130
THR A 139
VAL A 208
PHE A 328
 None
E2J  A1201 (-4.3A)
None
E2J  A1201 (-4.4A)
 0.82A 4iarA-6bqhA:
29.6		 4iarA-6bqhA:
9.87
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.
6bqh 5-HYDROXYTRYPTAMINE
RECEPTOR 2C,SOLUBLE
CYTOCHROME B562

(Escherichia
coli;
Homo sapiens) 		no annotation 4 TRP A 130
THR A 139
VAL A 208
SER A 219
 None
E2J  A1201 (-4.3A)
None
E2J  A1201 (-3.2A)
 0.82A 4iarA-6bqhA:
29.6		 4iarA-6bqhA:
9.87
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.
6ci9 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
REDUCTASE

(Mycolicibacterium
smegmatis) 		no annotation 4 ILE A  19
THR A 192
VAL A 140
PHE A  95
 NAP  A 301 (-3.8A)
NAP  A 301 (-2.9A)
None
F3V  A 302 (-3.8A)
 0.81A 4iarA-6ci9A:
undetectable		 4iarA-6ci9A:
12.36
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.
6fyv DUAL SPECIFICITY
PROTEIN KINASE CLK4

(Homo sapiens) 		no annotation 4 THR A 381
VAL A 340
SER A 384
ASP A 361
 None
None
SO4  A 502 (-2.7A)
None
 1.23A 4iarA-6fyvA:
2.1		 4iarA-6fyvA:
undetectable
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
6g79 5-HYDROXYTRYPTAMINE
RECEPTOR 1B

(Homo sapiens) 		no annotation 4 TRP S 125
ILE S 130
SER S 212
PHE S 331
 None
EP5  S 401 (-4.2A)
EP5  S 401 (-3.3A)
EP5  S 401 (-4.7A)
 0.74A 4iarA-6g79S:
34.6		 4iarA-6g79S:
95.18
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
6g79 5-HYDROXYTRYPTAMINE
RECEPTOR 1B

(Homo sapiens) 		no annotation 4 TRP S 125
ILE S 130
THR S 134
PHE S 331
 None
EP5  S 401 (-4.2A)
EP5  S 401 (-3.8A)
EP5  S 401 (-4.7A)
 0.43A 4iarA-6g79S:
34.6		 4iarA-6g79S:
95.18