SIMILAR PATTERNS OF AMINO ACIDS FOR 3V4T_A_ACTA505

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.
1cul TYPE II ADENYLYL
CYCLASE

(Rattus
norvegicus) 		PF00211
(Guanylate_cyc) 		3 THR B1042
ASN B1001
GLU B1044
 None
 0.72A 3v4tA-1culB:
0.0
3v4tC-1culB:
0.0		 3v4tA-1culB:
21.09
3v4tC-1culB:
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.
1f3o HYPOTHETICAL ABC
TRANSPORTER
ATP-BINDING PROTEIN
MJ0796

(Methanocaldococcus
jannaschii) 		PF00005
(ABC_tran) 		3 THR A   8
ASN A  23
GLU A  59
 None
 0.64A 3v4tA-1f3oA:
0.0
3v4tC-1f3oA:
0.0		 3v4tA-1f3oA:
22.91
3v4tC-1f3oA:
22.91
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.
1g8k ARSENITE OXIDASE
ARSENITE OXIDASE

(Alcaligenes
faecalis;
Alcaligenes
faecalis) 		PF00384
(Molybdopterin)
PF01568
(Molydop_binding)
PF00355
(Rieske) 		3 THR A 240
ASN A 241
GLU B  97
 F3S  A5005 ( 4.5A)
F3S  A5005 (-4.1A)
None
 0.67A 3v4tA-1g8kA:
0.0
3v4tC-1g8kA:
0.0		 3v4tA-1g8kA:
19.49
3v4tC-1g8kA:
19.49
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.
1mqt POLYPROTEIN CAPSID
PROTEIN

(Enterovirus B) 		PF00073
(Rhv) 		3 THR C  58
ASN C  56
GLU C  59
 None
 0.77A 3v4tA-1mqtC:
0.0
3v4tC-1mqtC:
0.0		 3v4tA-1mqtC:
18.87
3v4tC-1mqtC:
18.87
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.
1mt5 FATTY-ACID AMIDE
HYDROLASE

(Rattus
norvegicus) 		PF01425
(Amidase) 		3 THR A 115
ASN A 186
GLU A 143
 None
 0.68A 3v4tA-1mt5A:
0.0
3v4tC-1mt5A:
0.0		 3v4tA-1mt5A:
23.20
3v4tC-1mt5A:
23.20
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.
1my6 IRON (III)
SUPEROXIDE DISMUTASE

(Thermosynechococcus
elongatus) 		PF00081
(Sod_Fe_N)
PF02777
(Sod_Fe_C) 		3 THR A  80
ASN A  84
GLU A   5
 None
 0.77A 3v4tA-1my6A:
0.0
3v4tC-1my6A:
0.0		 3v4tA-1my6A:
20.43
3v4tC-1my6A:
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.
1qqg INSULIN RECEPTOR
SUBSTRATE 1

(Homo sapiens) 		PF00169
(PH)
PF02174
(IRS) 		3 THR A 252
ASN A 248
GLU A 162
 None
 0.72A 3v4tA-1qqgA:
0.0
3v4tC-1qqgA:
0.0		 3v4tA-1qqgA:
21.11
3v4tC-1qqgA:
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.
1rf5 5-ENOLPYRUVYLSHIKIMA
TE-3-PHOSPHATE
SYNTHASE

(Streptococcus
pneumoniae) 		PF00275
(EPSP_synthase) 		3 THR A 289
ASN A 255
GLU A 280
 None
 0.62A 3v4tA-1rf5A:
32.8
3v4tC-1rf5A:
33.0		 3v4tA-1rf5A:
26.65
3v4tC-1rf5A:
26.65
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.
1rwl SERINE/THREONINE-PRO
TEIN KINASE PKND

(Mycobacterium
tuberculosis) 		PF01436
(NHL) 		3 THR A 212
ASN A 211
GLU A 209
 None
 0.78A 3v4tA-1rwlA:
undetectable
3v4tC-1rwlA:
undetectable		 3v4tA-1rwlA:
22.73
3v4tC-1rwlA:
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.
1uhd ASPARTATE
1-DECARBOXYLASE
ALPHA CHAIN

(Helicobacter
pylori) 		PF02261
(Asp_decarbox) 		3 THR A  27
ASN A  71
GLU A  67
 None
PYR  A  25 (-4.3A)
None
 0.71A 3v4tA-1uhdA:
undetectable
3v4tC-1uhdA:
undetectable		 3v4tA-1uhdA:
12.72
3v4tC-1uhdA:
12.72
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.
1xfa CYSTIC FIBROSIS
TRANSMEMBRANE
CONDUCTANCE
REGULATOR

(Mus musculus) 		PF00005
(ABC_tran)
PF14396
(CFTR_R) 		3 THR A 398
ASN A 443
GLU A 479
 None
 0.67A 3v4tA-1xfaA:
0.8
3v4tC-1xfaA:
0.7		 3v4tA-1xfaA:
22.43
3v4tC-1xfaA:
22.43
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.
1y7m HYPOTHETICAL PROTEIN
BSU14040

(Bacillus
subtilis) 		PF01476
(LysM)
PF03734
(YkuD) 		3 THR A 161
ASN A 163
GLU A  94
 None
 0.66A 3v4tA-1y7mA:
undetectable
3v4tC-1y7mA:
undetectable		 3v4tA-1y7mA:
18.57
3v4tC-1y7mA:
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.
2beo LISTERIOLYSIN
REGULATORY PROTEIN

(Listeria
monocytogenes) 		PF13545
(HTH_Crp_2) 		3 THR A  49
ASN A  59
GLU A  86
 None
 0.80A 3v4tA-2beoA:
undetectable
3v4tC-2beoA:
undetectable		 3v4tA-2beoA:
21.00
3v4tC-2beoA:
21.00
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.
2f17 THIAMIN
PYROPHOSPHOKINASE 1

(Mus musculus) 		PF04263
(TPK_catalytic)
PF04265
(TPK_B1_binding) 		3 THR A 196
ASN A 206
GLU A 230
 None
 0.66A 3v4tA-2f17A:
undetectable
3v4tC-2f17A:
undetectable		 3v4tA-2f17A:
20.75
3v4tC-2f17A:
20.75
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.
2pfv EXOCYST COMPLEX
COMPONENT EXO70

(Saccharomyces
cerevisiae) 		PF03081
(Exo70) 		3 THR A  67
ASN A  69
GLU A  80
 None
 0.69A 3v4tA-2pfvA:
1.1
3v4tC-2pfvA:
undetectable		 3v4tA-2pfvA:
21.32
3v4tC-2pfvA:
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.
2pop MITOGEN-ACTIVATED
PROTEIN KINASE
KINASE KINASE
7-INTERACTING
PROTEIN 1

(Homo sapiens) 		PF00481
(PP2C) 		3 THR A 185
ASN A 186
GLU A 290
 None
 0.79A 3v4tA-2popA:
undetectable
3v4tC-2popA:
undetectable		 3v4tA-2popA:
23.89
3v4tC-2popA:
23.89
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.
2qzi UNCHARACTERIZED
PROTEIN

(Streptococcus
thermophilus) 		PF08860
(DUF1827) 		3 THR A  34
ASN A  33
GLU A  60
 None
 0.75A 3v4tA-2qziA:
undetectable
3v4tC-2qziA:
undetectable		 3v4tA-2qziA:
16.40
3v4tC-2qziA:
16.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2r05 PROGRAMMED CELL
DEATH 6-INTERACTING
PROTEIN

(Homo sapiens) 		PF03097
(BRO1)
PF13949
(ALIX_LYPXL_bnd) 		3 THR A 674
ASN A 678
GLU A 439
 None
 0.68A 3v4tA-2r05A:
undetectable
3v4tC-2r05A:
undetectable		 3v4tA-2r05A:
21.32
3v4tC-2r05A:
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.
2vdt LEVANSUCRASE

(Bacillus
subtilis) 		PF02435
(Glyco_hydro_68) 		3 THR A 244
ASN A 264
GLU A 262
 None
CA  A1473 (-3.8A)
None
 0.75A 3v4tA-2vdtA:
undetectable
3v4tC-2vdtA:
undetectable		 3v4tA-2vdtA:
20.52
3v4tC-2vdtA:
20.52
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.
2vha PERIPLASMIC BINDING
TRANSPORT PROTEIN

(Shigella
flexneri) 		PF00497
(SBP_bac_3) 		3 THR A  92
ASN A  94
GLU A 209
 GLU  A1280 (-4.0A)
None
None
 0.82A 3v4tA-2vhaA:
undetectable
3v4tC-2vhaA:
undetectable		 3v4tA-2vhaA:
21.36
3v4tC-2vhaA:
21.36
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.
2voy POTENTIAL
COPPER-TRANSPORTING
ATPASE

(Bacillus
subtilis) 		PF00403
(HMA) 		3 THR A  42
ASN A  37
GLU A   6
 None
 0.76A 3v4tA-2voyA:
undetectable
3v4tC-2voyA:
undetectable		 3v4tA-2voyA:
12.62
3v4tC-2voyA:
12.62
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2w4g MYOSIN HEAVY CHAIN,
SKELETAL MUSCLE,
ADULT

(Gallus gallus) 		PF00063
(Myosin_head)
PF02736
(Myosin_N) 		3 THR M 648
ASN M 599
GLU M 537
 None
 0.73A 3v4tA-2w4gM:
undetectable
3v4tC-2w4gM:
undetectable		 3v4tA-2w4gM:
20.05
3v4tC-2w4gM:
20.05
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.
2y7l AGGLUTININ-LIKE ALS9
PROTEIN

(Candida
albicans) 		PF11766
(Candida_ALS_N) 		3 THR A 122
ASN A 213
GLU A  86
 None
 0.81A 3v4tA-2y7lA:
undetectable
3v4tC-2y7lA:
undetectable		 3v4tA-2y7lA:
21.94
3v4tC-2y7lA:
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.
3aup BASIC 7S GLOBULIN

(Glycine max) 		PF14541
(TAXi_C)
PF14543
(TAXi_N) 		3 THR A 225
ASN A 231
GLU A 229
 None
 0.43A 3v4tA-3aupA:
undetectable
3v4tC-3aupA:
undetectable		 3v4tA-3aupA:
22.55
3v4tC-3aupA:
22.55
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.
3ayh DNA-DIRECTED RNA
POLYMERASE III
SUBUNIT RPC9
DNA-DIRECTED RNA
POLYMERASE III
SUBUNIT RPC8

(Schizosaccharomyces
pombe;
Schizosaccharomyces
pombe) 		PF03874
(RNA_pol_Rpb4)
PF03876
(SHS2_Rpb7-N)
PF08292
(RNA_pol_Rbc25) 		3 THR A  47
ASN B  36
GLU A  51
 None
 0.77A 3v4tA-3ayhA:
undetectable
3v4tC-3ayhA:
undetectable		 3v4tA-3ayhA:
15.25
3v4tC-3ayhA:
15.25
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.
3bit FACT COMPLEX SUBUNIT
SPT16

(Saccharomyces
cerevisiae) 		PF00557
(Peptidase_M24)
PF14826
(FACT-Spt16_Nlob) 		3 THR A  49
ASN A  53
GLU A  59
 None
 0.68A 3v4tA-3bitA:
undetectable
3v4tC-3bitA:
undetectable		 3v4tA-3bitA:
22.49
3v4tC-3bitA:
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.
3c7o ENDO-1,4-BETA-XYLANA
SE

(Bacillus
subtilis) 		PF03422
(CBM_6)
PF04616
(Glyco_hydro_43) 		3 THR A 387
ASN A 478
GLU A 372
 None
FMT  A2055 ( 4.4A)
None
 0.66A 3v4tA-3c7oA:
undetectable
3v4tC-3c7oA:
undetectable		 3v4tA-3c7oA:
21.79
3v4tC-3c7oA:
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.
3d8x THIOREDOXIN
REDUCTASE 1

(Saccharomyces
cerevisiae) 		PF07992
(Pyr_redox_2) 		3 THR A 101
ASN A 104
GLU A  85
 None
 0.81A 3v4tA-3d8xA:
undetectable
3v4tC-3d8xA:
1.1		 3v4tA-3d8xA:
22.79
3v4tC-3d8xA:
22.79
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.
3eh2 PROTEIN TRANSPORT
PROTEIN SEC24C

(Homo sapiens) 		PF00626
(Gelsolin)
PF04810
(zf-Sec23_Sec24)
PF04811
(Sec23_trunk)
PF04815
(Sec23_helical)
PF08033
(Sec23_BS) 		3 THR A  31
ASN A 617
GLU A   7
 None
 0.78A 3v4tA-3eh2A:
undetectable
3v4tC-3eh2A:
1.1		 3v4tA-3eh2A:
20.99
3v4tC-3eh2A:
20.99
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.
3fjy PROBABLE MUTT1
PROTEIN

(Bifidobacterium
adolescentis) 		PF00293
(NUDIX)
PF00300
(His_Phos_1) 		3 THR A 235
ASN A 233
GLU A 294
 None
 0.79A 3v4tA-3fjyA:
undetectable
3v4tC-3fjyA:
undetectable		 3v4tA-3fjyA:
22.07
3v4tC-3fjyA:
22.07
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.
3h7a SHORT CHAIN
DEHYDROGENASE

(Rhodopseudomonas
palustris) 		PF00106
(adh_short) 		3 THR A  70
ASN A  74
GLU A 122
 THR  A  70 ( 0.8A)
ASN  A  74 ( 0.6A)
GLU  A 122 ( 0.6A)
 0.69A 3v4tA-3h7aA:
undetectable
3v4tC-3h7aA:
0.3		 3v4tA-3h7aA:
20.29
3v4tC-3h7aA:
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.
3hh8 METAL ABC
TRANSPORTER
SUBSTRATE-BINDING
LIPOPROTEIN

(Streptococcus
pyogenes) 		PF01297
(ZnuA) 		3 THR A  38
ASN A  39
GLU A  93
 None
 0.71A 3v4tA-3hh8A:
undetectable
3v4tC-3hh8A:
undetectable		 3v4tA-3hh8A:
21.82
3v4tC-3hh8A:
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.
3lpp SUCRASE-ISOMALTASE

(Homo sapiens) 		PF00088
(Trefoil)
PF01055
(Glyco_hydro_31)
PF16863
(NtCtMGAM_N) 		3 THR A 224
ASN A 238
GLU A 270
 None
 0.59A 3v4tA-3lppA:
undetectable
3v4tC-3lppA:
undetectable		 3v4tA-3lppA:
18.23
3v4tC-3lppA:
18.23
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.
3m52 ZINC FINGER AND BTB
DOMAIN-CONTAINING
PROTEIN 17

(Homo sapiens) 		PF00651
(BTB) 		3 THR A  79
ASN A  15
GLU A  75
 None
 0.72A 3v4tA-3m52A:
undetectable
3v4tC-3m52A:
undetectable		 3v4tA-3m52A:
15.57
3v4tC-3m52A:
15.57
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.
3mj9 JUNCTIONAL ADHESION
MOLECULE-LIKE

(Mus musculus) 		PF07686
(V-set) 		3 THR A  30
ASN A  80
GLU A  32
 FUC  A 506 (-3.1A)
FUC  A 506 (-3.9A)
None
 0.81A 3v4tA-3mj9A:
undetectable
3v4tC-3mj9A:
undetectable		 3v4tA-3mj9A:
19.81
3v4tC-3mj9A:
19.81
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.
3no4 CREATININE
AMIDOHYDROLASE

(Nostoc
punctiforme) 		PF02633
(Creatininase) 		3 THR A  62
ASN A  64
GLU A  45
 None
 0.81A 3v4tA-3no4A:
undetectable
3v4tC-3no4A:
0.6		 3v4tA-3no4A:
22.27
3v4tC-3no4A:
22.27
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.
3ogg BOTULINUM NEUROTOXIN
TYPE D

(Clostridium
botulinum) 		PF07951
(Toxin_R_bind_C)
PF07953
(Toxin_R_bind_N) 		3 THR A1252
ASN A1253
GLU A1226
 None
 0.75A 3v4tA-3oggA:
undetectable
3v4tC-3oggA:
undetectable		 3v4tA-3oggA:
23.14
3v4tC-3oggA:
23.14
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.
3om5 LEVANSUCRASE

(Bacillus
megaterium) 		PF02435
(Glyco_hydro_68) 		3 THR A 254
ASN A 274
GLU A 272
 None
CA  A   1 ( 4.8A)
None
 0.74A 3v4tA-3om5A:
undetectable
3v4tC-3om5A:
undetectable		 3v4tA-3om5A:
21.01
3v4tC-3om5A:
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.
3otn SUSD SUPERFAMILY
PROTEIN

(Parabacteroides
distasonis) 		PF07980
(SusD_RagB)
PF14322
(SusD-like_3) 		3 THR A  47
ASN A  48
GLU A 141
 None
EDO  A 634 ( 3.9A)
None
 0.77A 3v4tA-3otnA:
undetectable
3v4tC-3otnA:
undetectable		 3v4tA-3otnA:
22.33
3v4tC-3otnA:
22.33
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.
3qc2 GLYCOSYL HYDROLASE

(Bacteroides
ovatus) 		PF04041
(Glyco_hydro_130) 		3 THR A  57
ASN A  56
GLU A  71
 None
 0.79A 3v4tA-3qc2A:
undetectable
3v4tC-3qc2A:
undetectable		 3v4tA-3qc2A:
23.52
3v4tC-3qc2A:
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.
3s6p CAPSID PROTEIN

(Helicoverpa
armigera stunt
virus) 		PF03566
(Peptidase_A21) 		3 THR A 213
ASN A 172
GLU A 174
 None
 0.74A 3v4tA-3s6pA:
undetectable
3v4tC-3s6pA:
undetectable		 3v4tA-3s6pA:
23.30
3v4tC-3s6pA:
23.30
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.
3tb6 ARABINOSE METABOLISM
TRANSCRIPTIONAL
REPRESSOR

(Bacillus
subtilis) 		PF13377
(Peripla_BP_3) 		3 THR A  87
ASN A 119
GLU A 142
 None
None
ARB  A 400 (-4.4A)
 0.74A 3v4tA-3tb6A:
undetectable
3v4tC-3tb6A:
undetectable		 3v4tA-3tb6A:
21.14
3v4tC-3tb6A:
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.
3ul4 CELLULOSOME-ANCHORIN
G PROTEIN
CELLULOSOME ENZYME,
DOCKERIN TYPE I

(Ruminiclostridium
thermocellum;
Ruminiclostridium
thermocellum) 		PF00963
(Cohesin)
PF00404
(Dockerin_1) 		3 THR B  50
ASN B  42
GLU A 134
 None
CA  B  66 (-3.0A)
None
 0.72A 3v4tA-3ul4B:
undetectable
3v4tC-3ul4B:
undetectable		 3v4tA-3ul4B:
8.41
3v4tC-3ul4B:
8.41
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.
3wbz LIKELY HISTIDYL
TRNA-SPECIFIC
GUANYLYLTRANSFERASE

(Candida
albicans) 		PF04446
(Thg1)
PF14413
(Thg1C) 		3 THR A 161
ASN A 157
GLU A 204
 None
 0.74A 3v4tA-3wbzA:
undetectable
3v4tC-3wbzA:
undetectable		 3v4tA-3wbzA:
19.71
3v4tC-3wbzA:
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.
4amc GLUCANSUCRASE

(Lactobacillus
reuteri) 		PF01473
(CW_binding_1)
PF02324
(Glyco_hydro_70) 		3 THR A1527
ASN A1542
GLU A 947
 None
 0.78A 3v4tA-4amcA:
undetectable
3v4tC-4amcA:
undetectable		 3v4tA-4amcA:
18.28
3v4tC-4amcA:
18.28
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.
4bok ALPHA-1,6-MANNANASE

(Bacillus
circulans) 		PF03663
(Glyco_hydro_76) 		3 THR A 179
ASN A 181
GLU A 231
 None
 0.80A 3v4tA-4bokA:
undetectable
3v4tC-4bokA:
undetectable		 3v4tA-4bokA:
22.82
3v4tC-4bokA:
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.
4c3h DNA-DIRECTED RNA
POLYMERASE I SUBUNIT
RPA12

(Saccharomyces
cerevisiae) 		PF01096
(TFIIS_C)
PF02150
(RNA_POL_M_15KD) 		3 THR I 115
ASN I  95
GLU I  93
 None
 0.71A 3v4tA-4c3hI:
undetectable
3v4tC-4c3hI:
undetectable		 3v4tA-4c3hI:
16.26
3v4tC-4c3hI:
16.26
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.
4chg PROBABLE
RIBONUCLEASE VAPC15
ANTITOXIN VAPB15

(Mycobacterium
tuberculosis;
Mycobacterium
tuberculosis) 		PF01850
(PIN)
PF09957
(VapB_antitoxin) 		3 THR A   5
ASN G  63
GLU A  42
 None
MG  A1134 ( 4.1A)
MG  A1134 ( 3.8A)
 0.71A 3v4tA-4chgA:
undetectable
3v4tC-4chgA:
undetectable		 3v4tA-4chgA:
18.89
3v4tC-4chgA:
18.89
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.
4di0 RUBRERYTHRIN

(Burkholderia
pseudomallei) 		PF02915
(Rubrerythrin) 		3 THR A  54
ASN A  24
GLU A  51
 EDO  A 204 (-4.4A)
None
None
 0.55A 3v4tA-4di0A:
undetectable
3v4tC-4di0A:
undetectable		 3v4tA-4di0A:
17.27
3v4tC-4di0A:
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.
4dy5 GIFSY-1 PROPHAGE
PROTEIN

(Salmonella
enterica) 		PF04151
(PPC) 		3 THR A  51
ASN A  26
GLU A 108
 None
 0.54A 3v4tA-4dy5A:
undetectable
3v4tC-4dy5A:
undetectable		 3v4tA-4dy5A:
12.95
3v4tC-4dy5A:
12.95
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.
4fl4 GLYCOSIDE HYDROLASE
FAMILY 9
CELLULOSOME
ANCHORING PROTEIN
COHESIN REGION

(Ruminiclostridium
thermocellum;
Ruminiclostridium
thermocellum) 		PF00404
(Dockerin_1)
PF00963
(Cohesin) 		3 THR A  34
ASN A  26
GLU C 137
 None
CA  A 101 (-2.9A)
None
 0.76A 3v4tA-4fl4A:
undetectable
3v4tC-4fl4A:
undetectable		 3v4tA-4fl4A:
11.86
3v4tC-4fl4A:
11.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4hoo LYSINE-SPECIFIC
DEMETHYLASE 4D

(Homo sapiens) 		PF02373
(JmjC)
PF02375
(JmjN) 		3 THR A 177
ASN A 176
GLU A 173
 None
 0.78A 3v4tA-4hooA:
undetectable
3v4tC-4hooA:
undetectable		 3v4tA-4hooA:
20.52
3v4tC-4hooA:
20.52
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.
4j5t MANNOSYL-OLIGOSACCHA
RIDE GLUCOSIDASE

(Saccharomyces
cerevisiae) 		PF03200
(Glyco_hydro_63)
PF16923
(Glyco_hydro_63N) 		3 THR A   8
ASN A   9
GLU A 410
 None
NAG  A1001 (-2.3A)
None
 0.80A 3v4tA-4j5tA:
undetectable
3v4tC-4j5tA:
undetectable		 3v4tA-4j5tA:
20.21
3v4tC-4j5tA:
20.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4kh8 HYPOTHETICAL PROTEIN

(Enterococcus
faecalis) 		PF16103
(DUF4822) 		3 THR A 234
ASN A 232
GLU A 335
 None
 0.67A 3v4tA-4kh8A:
undetectable
3v4tC-4kh8A:
undetectable		 3v4tA-4kh8A:
20.00
3v4tC-4kh8A:
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.
4l7t NANU SIALIC ACID
BINDING PROTEIN

(Bacteroides
fragilis) 		PF07980
(SusD_RagB)
PF14322
(SusD-like_3) 		3 THR A 345
ASN A 364
GLU A 313
 None
 0.78A 3v4tA-4l7tA:
undetectable
3v4tC-4l7tA:
undetectable		 3v4tA-4l7tA:
21.72
3v4tC-4l7tA:
21.72
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.
4liy FIBER PROTEIN

(Human
mastadenovirus
B) 		PF00541
(Adeno_knob) 		3 THR A 132
ASN A 131
GLU A 217
 None
 0.61A 3v4tA-4liyA:
undetectable
3v4tC-4liyA:
undetectable		 3v4tA-4liyA:
22.25
3v4tC-4liyA:
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.
4nnp LIPOPROTEIN

(Staphylococcus
aureus) 		PF01297
(ZnuA) 		3 THR A  38
ASN A  39
GLU A  93
 None
 0.75A 3v4tA-4nnpA:
undetectable
3v4tC-4nnpA:
undetectable		 3v4tA-4nnpA:
22.97
3v4tC-4nnpA:
22.97
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.
4nw4 LIPOPROTEIN S-LAYER
PROTEIN

(Enterococcus
faecalis) 		PF16103
(DUF4822) 		3 THR A 208
ASN A 206
GLU A 309
 None
 0.72A 3v4tA-4nw4A:
undetectable
3v4tC-4nw4A:
undetectable		 3v4tA-4nw4A:
21.09
3v4tC-4nw4A:
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.
4oj2 AQUAPORIN-2

(Homo sapiens) 		PF00230
(MIP) 		3 THR X 179
ASN X 119
GLU X 134
 None
 0.80A 3v4tA-4oj2X:
undetectable
3v4tC-4oj2X:
undetectable		 3v4tA-4oj2X:
22.51
3v4tC-4oj2X:
22.51
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.
4qan HYPOTHETICAL PROTEIN

([Ruminococcus]
gnavus) 		no annotation 3 THR A 345
ASN A 348
GLU A 347
 None
 0.81A 3v4tA-4qanA:
undetectable
3v4tC-4qanA:
undetectable		 3v4tA-4qanA:
22.99
3v4tC-4qanA:
22.99
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.
4qhr ALANINE RACEMASE

(Acinetobacter
baumannii) 		PF00842
(Ala_racemase_C)
PF01168
(Ala_racemase_N) 		3 THR A 338
ASN A 336
GLU A 342
 None
 0.42A 3v4tA-4qhrA:
undetectable
3v4tC-4qhrA:
undetectable		 3v4tA-4qhrA:
22.96
3v4tC-4qhrA:
22.96
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.
4raa PUTATIVE EXPORTED
PROTEIN

(Bacteroides
fragilis) 		PF17170
(DUF5128) 		3 THR A 215
ASN A 216
GLU A 159
 None
 0.64A 3v4tA-4raaA:
undetectable
3v4tC-4raaA:
undetectable		 3v4tA-4raaA:
21.98
3v4tC-4raaA:
21.98
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.
4rap GLYCOSYLTRANSFERASE
TIBC

(Escherichia
coli) 		PF01075
(Glyco_transf_9) 		3 THR A 236
ASN A 234
GLU A 240
 None
 0.75A 3v4tA-4rapA:
undetectable
3v4tC-4rapA:
undetectable		 3v4tA-4rapA:
23.83
3v4tC-4rapA:
23.83
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.
4rk1 RIBOSE
TRANSCRIPTIONAL
REGULATOR

(Enterococcus
faecium) 		PF13377
(Peripla_BP_3) 		3 THR A 135
ASN A 139
GLU A 158
 None
 0.76A 3v4tA-4rk1A:
undetectable
3v4tC-4rk1A:
undetectable		 3v4tA-4rk1A:
21.57
3v4tC-4rk1A:
21.57
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.
4u2m ZINC FINGER AND BTB
DOMAIN-CONTAINING
PROTEIN 17,B-CELL
LYMPHOMA 6 PROTEIN

(Homo sapiens) 		PF00651
(BTB) 		3 THR A  79
ASN A  15
GLU A  75
 None
 0.78A 3v4tA-4u2mA:
undetectable
3v4tC-4u2mA:
undetectable		 3v4tA-4u2mA:
21.69
3v4tC-4u2mA:
21.69
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4uvk ZYRO0D15994P

(Zygosaccharomyces
rouxii) 		PF08514
(STAG) 		3 THR A 703
ASN A 774
GLU A 817
 None
 0.80A 3v4tA-4uvkA:
undetectable
3v4tC-4uvkA:
undetectable		 3v4tA-4uvkA:
19.39
3v4tC-4uvkA:
19.39
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.
4v0k ARF-LIKE SMALL
GTPASE

(Chlamydomonas
reinhardtii) 		PF00025
(Arf) 		3 THR A  64
ASN A  19
GLU A  57
 None
 0.65A 3v4tA-4v0kA:
undetectable
3v4tC-4v0kA:
undetectable		 3v4tA-4v0kA:
18.88
3v4tC-4v0kA:
18.88
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.
4v23 MATRIX PROTEIN

(Respiratory
syncytial virus) 		PF03393
(Pneumo_matrix) 		3 THR A 176
ASN A 175
GLU A 178
 None
 0.72A 3v4tA-4v23A:
undetectable
3v4tC-4v23A:
undetectable		 3v4tA-4v23A:
20.76
3v4tC-4v23A:
20.76
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.
4xgc ORIGIN RECOGNITION
COMPLEX SUBUNIT 4

(Drosophila
melanogaster) 		PF13191
(AAA_16)
PF14629
(ORC4_C) 		3 THR D  63
ASN D  67
GLU D 147
 None
 0.56A 3v4tA-4xgcD:
undetectable
3v4tC-4xgcD:
undetectable		 3v4tA-4xgcD:
22.95
3v4tC-4xgcD:
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.
4yrd CAPSULAR
POLYSACCHARIDE
SYNTHESIS ENZYME
CAP5F

(Staphylococcus
aureus) 		PF01370
(Epimerase) 		3 THR A 284
ASN A 338
GLU A 340
 None
 0.72A 3v4tA-4yrdA:
undetectable
3v4tC-4yrdA:
1.0		 3v4tA-4yrdA:
23.01
3v4tC-4yrdA:
23.01
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.
4yyw FICIN ISOFORM D

(Ficus carica) 		PF00112
(Peptidase_C1) 		3 THR A 171
ASN A 176
GLU A   3
 None
 0.78A 3v4tA-4yywA:
undetectable
3v4tC-4yywA:
undetectable		 3v4tA-4yywA:
19.44
3v4tC-4yywA:
19.44
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.
4z0c TOLL-LIKE RECEPTOR
13

(Mus musculus) 		PF00560
(LRR_1)
PF13516
(LRR_6)
PF13855
(LRR_8) 		3 THR A 232
ASN A 233
GLU A 255
 NAG  A 905 ( 3.9A)
NAG  A 905 (-1.7A)
NAG  A 907 (-2.8A)
 0.81A 3v4tA-4z0cA:
undetectable
3v4tC-4z0cA:
undetectable		 3v4tA-4z0cA:
18.57
3v4tC-4z0cA:
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.
4ztb PROTEASE NSP2

(Chikungunya
virus) 		PF01707
(Peptidase_C9) 		3 THR A 308
ASN A 312
GLU A 265
 None
 0.76A 3v4tA-4ztbA:
2.9
3v4tC-4ztbA:
undetectable		 3v4tA-4ztbA:
22.56
3v4tC-4ztbA:
22.56
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.
4zv4 ELONGATION FACTOR TU

(Pseudomonas
aeruginosa) 		PF00009
(GTP_EFTU)
PF03143
(GTP_EFTU_D3)
PF03144
(GTP_EFTU_D2) 		3 THR A  65
ASN A  91
GLU A  56
 None
 0.76A 3v4tA-4zv4A:
undetectable
3v4tC-4zv4A:
undetectable		 3v4tA-4zv4A:
22.66
3v4tC-4zv4A:
22.66
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.
5c5x AQUAPORIN-5

(Homo sapiens) 		PF00230
(MIP) 		3 THR A 180
ASN A 120
GLU A 135
 None
 0.77A 3v4tA-5c5xA:
undetectable
3v4tC-5c5xA:
undetectable		 3v4tA-5c5xA:
23.47
3v4tC-5c5xA:
23.47
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.
5dxl TREHALOSE-6-PHOSPHAT
E PHOSPHATASE

(Aspergillus
fumigatus) 		PF02358
(Trehalose_PPase) 		3 THR A 138
ASN A 178
GLU A 180
 None
 0.78A 3v4tA-5dxlA:
undetectable
3v4tC-5dxlA:
undetectable		 3v4tA-5dxlA:
20.67
3v4tC-5dxlA:
20.67
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.
5eyy CENTROLOBIUM
TOMENTOSUM LECTIN

(Centrolobium
tomentosum) 		PF00139
(Lectin_legB) 		3 THR A 170
ASN A 172
GLU A 230
 None
 0.56A 3v4tA-5eyyA:
undetectable
3v4tC-5eyyA:
undetectable		 3v4tA-5eyyA:
18.71
3v4tC-5eyyA:
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.
5h7w VENOM
5'-NUCLEOTIDASE

(Naja atra) 		no annotation 3 THR A 178
ASN A 117
GLU A 180
 None
ZN  A 606 (-2.6A)
None
 0.81A 3v4tA-5h7wA:
undetectable
3v4tC-5h7wA:
undetectable		 3v4tA-5h7wA:
22.32
3v4tC-5h7wA:
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.
5hl3 LMO2470 PROTEIN

(Listeria
monocytogenes) 		PF00560
(LRR_1)
PF12354
(Internalin_N)
PF13855
(LRR_8) 		3 THR A 386
ASN A 388
GLU A 362
 None
 0.80A 3v4tA-5hl3A:
undetectable
3v4tC-5hl3A:
undetectable		 3v4tA-5hl3A:
20.79
3v4tC-5hl3A:
20.79
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.
5i2t PERIODIC TRYPTOPHAN
PROTEIN 2

(Saccharomyces
cerevisiae) 		PF00400
(WD40) 		3 THR A 313
ASN A 311
GLU A 315
 None
 0.76A 3v4tA-5i2tA:
undetectable
3v4tC-5i2tA:
undetectable		 3v4tA-5i2tA:
19.49
3v4tC-5i2tA:
19.49
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.
5i4e MYOSIN-14,ALPHA-ACTI
NIN A

(Homo sapiens;
Dictyostelium
discoideum) 		PF00063
(Myosin_head)
PF00435
(Spectrin)
PF02736
(Myosin_N) 		3 THR A 386
ASN A 385
GLU A 383
 None
 0.58A 3v4tA-5i4eA:
undetectable
3v4tC-5i4eA:
undetectable		 3v4tA-5i4eA:
19.16
3v4tC-5i4eA:
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.
5i9q 426C.TM4DV1-3 P120

(Human
immunodeficiency
virus 1) 		PF00516
(GP120) 		3 THR A 123
ASN A 197
GLU A 429
 None
 0.70A 3v4tA-5i9qA:
undetectable
3v4tC-5i9qA:
undetectable		 3v4tA-5i9qA:
21.71
3v4tC-5i9qA:
21.71
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.
5iq6 RNA DEPENDENT RNA
POLYMERASE

(Dengue virus) 		PF00972
(Flavi_NS5) 		3 THR A 832
ASN A 835
GLU A 834
 None
 0.64A 3v4tA-5iq6A:
undetectable
3v4tC-5iq6A:
undetectable		 3v4tA-5iq6A:
23.51
3v4tC-5iq6A:
23.51
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.
5iqn PROTEIN FIMG

(Escherichia
coli) 		no annotation 3 THR A  95
ASN A  97
GLU A  87
 None
 0.58A 3v4tA-5iqnA:
undetectable
3v4tC-5iqnA:
undetectable		 3v4tA-5iqnA:
15.04
3v4tC-5iqnA:
15.04
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.
5lew DNA POLYMERASE III
SUBUNIT ALPHA

(Mycobacterium
tuberculosis) 		no annotation 3 THR A 116
ASN A 114
GLU A 150
 None
 0.78A 3v4tA-5lewA:
undetectable
3v4tC-5lewA:
undetectable		 3v4tA-5lewA:
20.04
3v4tC-5lewA:
20.04
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.
5mu7 COATOMER SUBUNIT
BETA
COATOMER SUBUNIT
DELTA-LIKE PROTEIN

(Chaetomium
thermophilum;
Chaetomium
thermophilum) 		PF01602
(Adaptin_N)
PF01217
(Clat_adaptor_s) 		3 THR A 187
ASN A 191
GLU B 123
 None
 0.79A 3v4tA-5mu7A:
undetectable
3v4tC-5mu7A:
undetectable		 3v4tA-5mu7A:
22.12
3v4tC-5mu7A:
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.
5nd7 KINESIN-LIKE PROTEIN
KIF20A

(Mus musculus) 		PF00225
(Kinesin) 		3 THR C 161
ASN C 162
GLU C 412
 ANP  C 602 ( 4.3A)
None
None
 0.81A 3v4tA-5nd7C:
0.5
3v4tC-5nd7C:
undetectable		 3v4tA-5nd7C:
23.35
3v4tC-5nd7C:
23.35
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.
5nzz TGF-BETA-ACTIVATED
KINASE 1 AND
MAP3K7-BINDING
PROTEIN 1

(Homo sapiens) 		no annotation 3 THR A 185
ASN A 186
GLU A 290
 None
 0.75A 3v4tA-5nzzA:
undetectable
3v4tC-5nzzA:
undetectable		 3v4tA-5nzzA:
undetectable
3v4tC-5nzzA:
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.
5t58 KLLA0F02343P

(Kluyveromyces
lactis) 		PF05859
(Mis12) 		3 THR A  39
ASN A  40
GLU A  69
 None
 0.74A 3v4tA-5t58A:
undetectable
3v4tC-5t58A:
undetectable		 3v4tA-5t58A:
20.38
3v4tC-5t58A:
20.38
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.
5u38 LECTIN

(Platypodium
elegans) 		PF00139
(Lectin_legB) 		3 THR A 170
ASN A 172
GLU A 230
 None
 0.59A 3v4tA-5u38A:
undetectable
3v4tC-5u38A:
undetectable		 3v4tA-5u38A:
18.36
3v4tC-5u38A:
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.
5ux5 BIFUNCTIONAL PROTEIN
PROLINE UTILIZATION
A (PUTA)

(Corynebacterium
freiburgense) 		PF00171
(Aldedh)
PF01619
(Pro_dh) 		3 THR A 933
ASN A 932
GLU A 983
 None
 0.73A 3v4tA-5ux5A:
0.9
3v4tC-5ux5A:
1.0		 3v4tA-5ux5A:
18.63
3v4tC-5ux5A:
18.63
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5vsj ALPHA-1,4-GLUCAN:MAL
TOSE-1-PHOSPHATE
MALTOSYLTRANSFERASE
1

(Streptomyces
coelicolor) 		PF00128
(Alpha-amylase)
PF11896
(DUF3416) 		3 THR A 660
ASN A 566
GLU A 633
 None
 0.77A 3v4tA-5vsjA:
0.3
3v4tC-5vsjA:
0.3		 3v4tA-5vsjA:
21.19
3v4tC-5vsjA:
21.19
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.
5vyl INNER TEGUMENT
PROTEIN

(Human
alphaherpesvirus
1) 		PF03970
(Herpes_UL37_1) 		3 THR A 483
ASN A 479
GLU A 473
 None
 0.75A 3v4tA-5vylA:
undetectable
3v4tC-5vylA:
undetectable		 3v4tA-5vylA:
24.46
3v4tC-5vylA:
24.46
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.
5w5j RECEPTOR-INTERACTING
SERINE/THREONINE-PRO
TEIN KINASE 2

(Homo sapiens) 		no annotation 3 THR A 149
ASN A 104
GLU A 221
 None
 0.80A 3v4tA-5w5jA:
undetectable
3v4tC-5w5jA:
undetectable		 3v4tA-5w5jA:
21.90
3v4tC-5w5jA:
21.90
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.
5w7q CONSENSUS ELONGATION
FACTOR

(synthetic
construct) 		no annotation 3 THR A  65
ASN A  91
GLU A  56
 None
 0.75A 3v4tA-5w7qA:
undetectable
3v4tC-5w7qA:
undetectable		 3v4tA-5w7qA:
undetectable
3v4tC-5w7qA:
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.
6a8m -

(-) 		no annotation 3 THR A  50
ASN A  54
GLU A  60
 None
 0.68A 3v4tA-6a8mA:
undetectable
3v4tC-6a8mA:
undetectable		 3v4tA-6a8mA:
undetectable
3v4tC-6a8mA:
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.
6ba5 INACTIVE
TYROSINE-PROTEIN
KINASE TRANSMEMBRANE
RECEPTOR ROR1

(Homo sapiens) 		no annotation 3 THR M 317
ASN M 364
GLU M 370
 None
 0.76A 3v4tA-6ba5M:
undetectable
3v4tC-6ba5M:
undetectable		 3v4tA-6ba5M:
undetectable
3v4tC-6ba5M:
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.
6ba5 INACTIVE
TYROSINE-PROTEIN
KINASE TRANSMEMBRANE
RECEPTOR ROR1

(Homo sapiens) 		no annotation 3 THR M 317
ASN M 367
GLU M 370
 None
 0.76A 3v4tA-6ba5M:
undetectable
3v4tC-6ba5M:
undetectable		 3v4tA-6ba5M:
undetectable
3v4tC-6ba5M:
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.
6c66 CRISPR-ASSOCIATED
PROTEIN, CSE1 FAMILY
CRISPR-ASSOCIATED
PROTEIN, CAS5E
FAMILY

(Thermobifida
fusca;
Thermobifida
fusca) 		no annotation
no annotation 		3 THR M 216
ASN M 201
GLU A  58
 None
G  J   3 ( 4.3A)
None
 0.75A 3v4tA-6c66M:
undetectable
3v4tC-6c66M:
undetectable		 3v4tA-6c66M:
undetectable
3v4tC-6c66M:
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.
6ehg HC3NB1

(Lama glama) 		no annotation 3 THR C 100
ASN C 111
GLU C 109
 None
 0.70A 3v4tA-6ehgC:
undetectable
3v4tC-6ehgC:
undetectable		 3v4tA-6ehgC:
undetectable
3v4tC-6ehgC:
undetectable