SIMILAR PATTERNS OF AMINO ACIDS FOR 4W9N_C_CCSC1548_0

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.
1a6u B1-8 FV (LIGHT
CHAIN)


(Mus musculus)
PF07686
(V-set)
3 ALA L  91
TRP L  98
VAL L  99
None
0.22A 4w9nC-1a6uL:
0.0
4w9nC-1a6uL:
15.13
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.
1a70 FERREDOXIN

(Spinacia
oleracea)
PF00111
(Fer2)
3 ALA A  48
TRP A  73
VAL A  74
None
0.43A 4w9nC-1a70A:
0.0
4w9nC-1a70A:
15.82
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.
1bhg BETA-GLUCURONIDASE

(Homo sapiens)
PF00703
(Glyco_hydro_2)
PF02836
(Glyco_hydro_2_C)
PF02837
(Glyco_hydro_2_N)
3 ALA A 171
TRP A  98
VAL A  99
None
NAG  A 651 (-3.9A)
None
0.36A 4w9nC-1bhgA:
0.0
4w9nC-1bhgA:
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.
1e1h BOTULINUM NEUROTOXIN
TYPE A LIGHT CHAIN


(Clostridium
botulinum)
PF01742
(Peptidase_M27)
3 ALA A  34
TRP A  42
VAL A  43
None
0.20A 4w9nC-1e1hA:
0.0
4w9nC-1e1hA:
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.
1fp9 4-ALPHA-GLUCANOTRANS
FERASE


(Thermus
thermophilus)
PF02446
(Glyco_hydro_77)
3 ALA A 300
TRP A 316
VAL A 317
None
0.21A 4w9nC-1fp9A:
0.0
4w9nC-1fp9A:
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.
1fy2 ASPARTYL DIPEPTIDASE

(Salmonella
enterica)
PF03575
(Peptidase_S51)
3 ALA A 220
TRP A 212
VAL A 213
None
0.35A 4w9nC-1fy2A:
2.5
4w9nC-1fy2A:
20.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1gpz COMPLEMENT C1R
COMPONENT


(Homo sapiens)
PF00084
(Sushi)
PF00089
(Trypsin)
3 ALA A 642
TRP A 651
VAL A 652
None
0.31A 4w9nC-1gpzA:
0.0
4w9nC-1gpzA:
22.90
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.
1gqp DOC1/APC10

(Saccharomyces
cerevisiae)
PF03256
(ANAPC10)
3 ALA A 170
TRP A 211
VAL A 212
None
0.24A 4w9nC-1gqpA:
undetectable
4w9nC-1gqpA:
21.07
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.
1jqi SHORT CHAIN ACYL-COA
DEHYDROGENASE


(Rattus
norvegicus)
PF00441
(Acyl-CoA_dh_1)
PF02770
(Acyl-CoA_dh_M)
PF02771
(Acyl-CoA_dh_N)
3 ALA A 146
TRP A 153
VAL A 154
None
0.36A 4w9nC-1jqiA:
0.0
4w9nC-1jqiA:
20.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1lox 15-LIPOXYGENASE

(Oryctolagus
cuniculus)
PF00305
(Lipoxygenase)
PF01477
(PLAT)
3 ALA A  75
TRP A 100
VAL A 101
None
0.39A 4w9nC-1loxA:
undetectable
4w9nC-1loxA:
21.38
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.
1md7 C1R COMPLEMENT
SERINE PROTEASE


(Homo sapiens)
PF00084
(Sushi)
PF00089
(Trypsin)
3 ALA A 642
TRP A 651
VAL A 652
None
0.38A 4w9nC-1md7A:
undetectable
4w9nC-1md7A:
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.
1p4i ANTIBODY VARIABLE
LIGHT CHAIN


(Mus musculus)
PF07686
(V-set)
3 ALA L 107
TRP L 137
VAL L 138
None
0.35A 4w9nC-1p4iL:
undetectable
4w9nC-1p4iL:
16.08
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.
1sng COG4826: SERINE
PROTEASE INHIBITOR


(Thermobifida
fusca)
PF00079
(Serpin)
3 ALA A 116
TRP A  90
VAL A  91
None
0.43A 4w9nC-1sngA:
undetectable
4w9nC-1sngA:
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.
1tdt TETRAHYDRODIPICOLINA
TE-N-SUCCINYLTRANSFE
RASE


(Mycobacterium
bovis)
PF00132
(Hexapep)
PF14602
(Hexapep_2)
PF14805
(THDPS_N_2)
3 ALA A  46
TRP A  53
VAL A  54
None
0.34A 4w9nC-1tdtA:
undetectable
4w9nC-1tdtA:
23.62
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.
1tz7 4-ALPHA-GLUCANOTRANS
FERASE


(Aquifex
aeolicus)
PF02446
(Glyco_hydro_77)
3 ALA A 293
TRP A 309
VAL A 310
None
0.34A 4w9nC-1tz7A:
undetectable
4w9nC-1tz7A:
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.
1wv8 HYPOTHETICAL PROTEIN
TTHA1013


(Thermus
thermophilus)
PF08972
(DUF1902)
3 ALA A   8
TRP A  17
VAL A  18
None
0.40A 4w9nC-1wv8A:
undetectable
4w9nC-1wv8A:
13.07
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.
2aey FRUCTAN
1-EXOHYDROLASE IIA


(Cichorium
intybus)
PF00251
(Glyco_hydro_32N)
PF08244
(Glyco_hydro_32C)
3 ALA A 112
TRP A 125
VAL A 126
None
0.44A 4w9nC-2aeyA:
undetectable
4w9nC-2aeyA:
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.
2arz HYPOTHETICAL PROTEIN
PA4388


(Pseudomonas
aeruginosa)
PF10615
(DUF2470)
PF13883
(Pyrid_oxidase_2)
3 ALA A  91
TRP A 125
VAL A 126
None
0.35A 4w9nC-2arzA:
undetectable
4w9nC-2arzA:
22.10
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.
2asu HEPATOCYTE GROWTH
FACTOR-LIKE PROTEIN


(Homo sapiens)
PF00089
(Trypsin)
3 ALA B 666
TRP B 673
VAL B 674
None
0.26A 4w9nC-2asuB:
undetectable
4w9nC-2asuB:
23.88
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.
2e7j SEP-TRNA:CYS-TRNA
SYNTHASE


(Archaeoglobus
fulgidus)
PF05889
(SepSecS)
3 ALA A 118
TRP A  95
VAL A  96
None
0.41A 4w9nC-2e7jA:
4.0
4w9nC-2e7jA:
22.77
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.
2eba PUTATIVE
GLUTARYL-COA
DEHYDROGENASE


(Thermus
thermophilus)
PF00441
(Acyl-CoA_dh_1)
PF02770
(Acyl-CoA_dh_M)
PF02771
(Acyl-CoA_dh_N)
3 ALA A 148
TRP A 155
VAL A 156
None
0.42A 4w9nC-2ebaA:
undetectable
4w9nC-2ebaA:
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.
2eis HYPOTHETICAL PROTEIN
TTHB207


(Thermus
thermophilus)
PF03061
(4HBT)
3 ALA A  97
TRP A  87
VAL A  88
None
0.42A 4w9nC-2eisA:
undetectable
4w9nC-2eisA:
17.99
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.
2fpq BOTULINUM NEUROTOXIN
D LIGHT CHAIN


(Clostridium
botulinum)
PF01742
(Peptidase_M27)
3 ALA A  36
TRP A  44
VAL A  45
None
0.20A 4w9nC-2fpqA:
undetectable
4w9nC-2fpqA:
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.
2jks BRADYZOITE SURFACE
ANTIGEN BSR4


(Toxoplasma
gondii)
PF04092
(SAG)
3 ALA A 255
TRP A 245
VAL A 246
None
0.23A 4w9nC-2jksA:
undetectable
4w9nC-2jksA:
23.82
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.
2nq5 5-METHYLTETRAHYDROPT
EROYLTRIGLUTAMATE--H
OMOCYSTEINE
METHYLTRANSFERASE


(Streptococcus
mutans)
PF01717
(Meth_synt_2)
PF08267
(Meth_synt_1)
3 ALA A 505
TRP A 497
VAL A 498
None
0.31A 4w9nC-2nq5A:
undetectable
4w9nC-2nq5A:
19.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2nv9 A207R PROTEIN,
ARGININE
DECARBOXYLASE


(Paramecium
bursaria
Chlorella virus
1)
PF00278
(Orn_DAP_Arg_deC)
PF02784
(Orn_Arg_deC_N)
3 ALA A 265
TRP A 344
VAL A 345
None
0.41A 4w9nC-2nv9A:
undetectable
4w9nC-2nv9A:
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.
2nz9 BOTULINUM NEUROTOXIN
TYPE A


(Clostridium
botulinum)
PF01742
(Peptidase_M27)
PF07951
(Toxin_R_bind_C)
PF07952
(Toxin_trans)
PF07953
(Toxin_R_bind_N)
3 ALA A  35
TRP A  43
VAL A  44
None
0.22A 4w9nC-2nz9A:
undetectable
4w9nC-2nz9A:
13.35
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.
2qn0 NEUROTOXIN

(Clostridium
botulinum)
PF01742
(Peptidase_M27)
3 ALA A  36
TRP A  44
VAL A  45
None
0.29A 4w9nC-2qn0A:
undetectable
4w9nC-2qn0A:
19.86
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.
2qy0 COMPLEMENT C1R
SUBCOMPONENT


(Homo sapiens)
PF00089
(Trypsin)
3 ALA B 642
TRP B 651
VAL B 652
None
0.42A 4w9nC-2qy0B:
undetectable
4w9nC-2qy0B:
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.
2vdc GLUTAMATE SYNTHASE
[NADPH] LARGE CHAIN


(Azospirillum
brasilense)
PF00310
(GATase_2)
PF01493
(GXGXG)
PF01645
(Glu_synthase)
PF04898
(Glu_syn_central)
3 ALA A 392
TRP A 340
VAL A 341
None
0.36A 4w9nC-2vdcA:
undetectable
4w9nC-2vdcA:
13.61
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.
2vz9 FATTY ACID SYNTHASE

(Sus scrofa)
PF00107
(ADH_zinc_N)
PF00109
(ketoacyl-synt)
PF00698
(Acyl_transf_1)
PF02801
(Ketoacyl-synt_C)
PF08242
(Methyltransf_12)
PF08659
(KR)
PF14765
(PS-DH)
PF16197
(KAsynt_C_assoc)
3 ALA A1531
TRP A1546
VAL A1547
None
0.41A 4w9nC-2vz9A:
undetectable
4w9nC-2vz9A:
12.29
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.
2wb7 PT26-6P

(Thermococcus
sp. 26-2)
no annotation 3 ALA A 416
TRP A 397
VAL A 398
None
0.36A 4w9nC-2wb7A:
undetectable
4w9nC-2wb7A:
20.83
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.
2x1i 4-ALPHA-GLUCANOTRANS
FERASE


(Thermus
brockianus)
PF02446
(Glyco_hydro_77)
3 ALA A 300
TRP A 316
VAL A 317
None
0.23A 4w9nC-2x1iA:
undetectable
4w9nC-2x1iA:
20.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3dfu UNCHARACTERIZED
PROTEIN FROM
6-PHOSPHOGLUCONATE
DEHYDROGENASE-LIKE
FAMILY


(Corynebacterium
glutamicum)
PF10727
(Rossmann-like)
3 ALA A  95
TRP A 103
VAL A 104
None
0.42A 4w9nC-3dfuA:
4.1
4w9nC-3dfuA:
22.16
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.
3dse BOTULINUM NEUROTOXIN
TYPE A


(Clostridium
botulinum)
PF01742
(Peptidase_M27)
3 ALA A  35
TRP A  43
VAL A  44
None
0.22A 4w9nC-3dseA:
undetectable
4w9nC-3dseA:
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.
3fcj NITROALKANE OXIDASE

(Fusarium
oxysporum)
PF00441
(Acyl-CoA_dh_1)
PF02771
(Acyl-CoA_dh_N)
3 ALA A 154
TRP A 161
VAL A 162
None
0.19A 4w9nC-3fcjA:
undetectable
4w9nC-3fcjA:
23.97
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.
3fw8 RETICULINE OXIDASE

(Eschscholzia
californica)
PF01565
(FAD_binding_4)
PF08031
(BBE)
3 ALA A 233
TRP A 138
VAL A 139
None
0.21A 4w9nC-3fw8A:
undetectable
4w9nC-3fw8A:
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.
3k3q BOTULINUM NEUROTOXIN
TYPE A


(Clostridium
botulinum)
PF01742
(Peptidase_M27)
3 ALA B  35
TRP B  43
VAL B  44
None
0.18A 4w9nC-3k3qB:
undetectable
4w9nC-3k3qB:
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.
3kg4 UNCHARACTERIZED
PROTEIN


([Mannheimia]
succiniciproducens)
PF09704
(Cas_Cas5d)
3 ALA A 118
TRP A  51
VAL A  52
None
0.40A 4w9nC-3kg4A:
undetectable
4w9nC-3kg4A:
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.
3kst ENDO-1,4-BETA-XYLANA
SE


(Bacteroides
thetaiotaomicron)
PF04616
(Glyco_hydro_43)
3 ALA A 244
TRP A 253
VAL A 254
None
0.42A 4w9nC-3kstA:
undetectable
4w9nC-3kstA:
20.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3mkh NITROALKANE OXIDASE

(Podospora
anserina)
PF00441
(Acyl-CoA_dh_1)
PF02771
(Acyl-CoA_dh_N)
3 ALA A 155
TRP A 162
VAL A 163
None
0.18A 4w9nC-3mkhA:
undetectable
4w9nC-3mkhA:
23.88
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.
3ngf AP ENDONUCLEASE,
FAMILY 2


(Brucella
abortus)
PF01261
(AP_endonuc_2)
3 ALA A   5
TRP A 235
VAL A 236
None
0.43A 4w9nC-3ngfA:
undetectable
4w9nC-3ngfA:
20.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3nnq N-TERMINAL DOMAIN OF
MOLONEY MURINE
LEUKEMIA VIRUS
INTEGRASE


(Murine leukemia
virus)
PF16721
(zf-H3C2)
3 ALA A  28
TRP A  37
VAL A  38
None
0.23A 4w9nC-3nnqA:
undetectable
4w9nC-3nnqA:
14.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ri5 MOUSE MONOCLONAL FAB
FRAGMENT, LIGHT
CHAIN


(Mus musculus)
PF07654
(C1-set)
PF07686
(V-set)
3 ALA K  91
TRP K  98
VAL K  99
None
0.30A 4w9nC-3ri5K:
undetectable
4w9nC-3ri5K:
21.28
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.
3s2g ZINC-CONTAINING
ALCOHOL
DEHYDROGENASE
SUPERFAMILY


(Cupriavidus
pinatubonensis)
PF00107
(ADH_zinc_N)
PF08240
(ADH_N)
3 ALA A 196
TRP A 171
VAL A 172
None
0.43A 4w9nC-3s2gA:
27.8
4w9nC-3s2gA:
27.08
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.
3ufk UNDA

(Shewanella sp.
HRCR_06)
PF13435
(Cytochrome_C554)
3 ALA A  98
TRP A 113
VAL A 114
None
0.31A 4w9nC-3ufkA:
undetectable
4w9nC-3ufkA:
17.50
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.
3ugg SUCROSE:(SUCROSE/FRU
CTAN)
6-FRUCTOSYLTRANSFERA
SE


(Pachysandra
terminalis)
PF00251
(Glyco_hydro_32N)
PF08244
(Glyco_hydro_32C)
3 ALA A 122
TRP A 135
VAL A 136
None
0.27A 4w9nC-3uggA:
undetectable
4w9nC-3uggA:
23.08
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.
3v0a NTNH

(Clostridium
botulinum)
PF01742
(Peptidase_M27)
PF07953
(Toxin_R_bind_N)
PF08470
(NTNH_C)
3 ALA B  32
TRP B  40
VAL B  41
None
0.35A 4w9nC-3v0aB:
undetectable
4w9nC-3v0aB:
11.93
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3v9a ESTERASE/LIPASE

(uncultured
bacterium)
PF07859
(Abhydrolase_3)
3 ALA A 100
TRP A  58
VAL A  59
None
0.25A 4w9nC-3v9aA:
2.7
4w9nC-3v9aA:
22.03
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.
3v9e LACCASE

(Botrytis aclada)
PF00394
(Cu-oxidase)
PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3)
3 ALA A 476
TRP A 411
VAL A 412
None
0.43A 4w9nC-3v9eA:
undetectable
4w9nC-3v9eA:
21.20
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.
3vte TETRAHYDROCANNABINOL
IC ACID SYNTHASE


(Cannabis sativa)
PF01565
(FAD_binding_4)
PF08031
(BBE)
3 ALA A 243
TRP A 148
VAL A 149
None
0.36A 4w9nC-3vteA:
undetectable
4w9nC-3vteA:
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.
3vuo NTNHA

(Clostridium
botulinum)
PF01742
(Peptidase_M27)
PF07953
(Toxin_R_bind_N)
PF08470
(NTNH_C)
3 ALA A  32
TRP A  40
VAL A  41
None
0.26A 4w9nC-3vuoA:
undetectable
4w9nC-3vuoA:
13.81
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.
3vzi CRISPR-ASSOCIATED
PROTEIN CAS5, DVULG
SUBTYPE


(Xanthomonas
oryzae)
PF09704
(Cas_Cas5d)
3 ALA A 118
TRP A  51
VAL A  52
None
0.30A 4w9nC-3vziA:
undetectable
4w9nC-3vziA:
23.41
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.
3zus BOTULINUM NEUROTOXIN
TYPE A,
SYNAPTOSOMAL-ASSOCIA
TED PROTEIN 23


(Clostridium
botulinum;
Homo sapiens)
PF01742
(Peptidase_M27)
PF07952
(Toxin_trans)
3 ALA A  35
TRP A  43
VAL A  44
None
0.19A 4w9nC-3zusA:
undetectable
4w9nC-3zusA:
16.15
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4aej COLLAGEN
ALPHA-1(III) CHAIN


(Homo sapiens)
PF01410
(COLFI)
3 ALA A  68
TRP A  57
VAL A  58
None
0.34A 4w9nC-4aejA:
undetectable
4w9nC-4aejA:
19.54
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.
4b1l LEVANASE

(Bacillus
subtilis)
PF06439
(DUF1080)
3 ALA A 574
TRP A 664
VAL A 663
FRU  A1678 ( 3.9A)
FRU  A1678 (-4.3A)
None
0.44A 4w9nC-4b1lA:
undetectable
4w9nC-4b1lA:
20.36
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.
4cdp PUTATIVE
HEME/HEMOGLOBIN
TRANSPORT PROTEIN


(Escherichia
coli)
PF05171
(HemS)
3 ALA A 218
TRP A 287
VAL A 288
EDO  A1346 (-4.6A)
None
None
0.42A 4w9nC-4cdpA:
undetectable
4w9nC-4cdpA:
22.86
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.
4fix UDP-GALACTOFURANOSYL
TRANSFERASE GLFT2


(Mycobacterium
tuberculosis)
PF13641
(Glyco_tranf_2_3)
3 ALA A  62
TRP A 132
VAL A 133
None
0.29A 4w9nC-4fixA:
undetectable
4w9nC-4fixA:
20.63
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.
4fpr AVIRULENCE EFFECTOR
AVRLM4-7


(Leptosphaeria
maculans)
no annotation 3 ALA A  25
TRP A 131
VAL A 132
None
0.18A 4w9nC-4fprA:
undetectable
4w9nC-4fprA:
15.63
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.
4gxb SORTING NEXIN-17

(Homo sapiens)
no annotation 3 ALA A 349
TRP A 361
VAL A 362
None
0.17A 4w9nC-4gxbA:
undetectable
4w9nC-4gxbA:
22.75
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.
4hxe PUTATIVE
UNCHARACTERIZED
PROTEIN PH0594


(Pyrococcus
horikoshii)
PF00326
(Peptidase_S9)
PF07676
(PD40)
3 ALA B  97
TRP B  88
VAL B  89
None
0.28A 4w9nC-4hxeB:
2.4
4w9nC-4hxeB:
19.27
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.
4jf7 HEMAGGLUTININ-NEURAM
INIDASE


(Mammalian
rubulavirus 5)
no annotation 3 ALA D 364
TRP D 300
VAL D 301
None
0.43A 4w9nC-4jf7D:
undetectable
4w9nC-4jf7D:
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.
4jg9 LIPOPROTEIN

(Bacillus
anthracis)
PF16167
(DUF4871)
3 ALA A 108
TRP A 155
VAL A 156
None
0.43A 4w9nC-4jg9A:
undetectable
4w9nC-4jg9A:
20.60
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.
4jkm BETA-GLUCURONIDASE

(Clostridium
perfringens)
PF00703
(Glyco_hydro_2)
PF02836
(Glyco_hydro_2_C)
PF02837
(Glyco_hydro_2_N)
3 ALA A 131
TRP A  65
VAL A  66
None
0.38A 4w9nC-4jkmA:
undetectable
4w9nC-4jkmA:
20.10
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.
4ktd GE136 LIGHT CHAIN
FAB


(Macaca mulatta)
PF07654
(C1-set)
PF07686
(V-set)
3 ALA L  89
TRP L  96
VAL L  97
None
0.22A 4w9nC-4ktdL:
undetectable
4w9nC-4ktdL:
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.
4lhf REGULATORY PROTEIN
COX


(Escherichia
virus P2)
PF10743
(Phage_Cox)
3 ALA A  11
TRP A  56
VAL A  57
None
0.25A 4w9nC-4lhfA:
undetectable
4w9nC-4lhfA:
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.
4lim DNA PRIMASE SMALL
SUBUNIT


(Saccharomyces
cerevisiae)
PF01896
(DNA_primase_S)
3 ALA A 167
TRP A 159
VAL A 160
None
0.12A 4w9nC-4limA:
undetectable
4w9nC-4limA:
22.62
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.
4lmh EXTRACELLULAR IRON
OXIDE RESPIRATORY
SYSTEM SURFACE
DECAHEME CYTOCHROME
C COMPONENT OMCA


(Shewanella
oneidensis)
no annotation 3 ALA A 659
TRP A 673
VAL A 674
None
0.33A 4w9nC-4lmhA:
undetectable
4w9nC-4lmhA:
18.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4n5f PUTATIVE ACYL-COA
DEHYDROGENASE


(Burkholderia
cenocepacia)
PF00441
(Acyl-CoA_dh_1)
PF02770
(Acyl-CoA_dh_M)
PF02771
(Acyl-CoA_dh_N)
3 ALA A 141
TRP A 148
VAL A 149
None
0.32A 4w9nC-4n5fA:
undetectable
4w9nC-4n5fA:
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.
4nzg INTEGRASE P46

(Murine leukemia
virus)
PF16721
(zf-H3C2)
3 ALA A  28
TRP A  37
VAL A  38
None
0.19A 4w9nC-4nzgA:
undetectable
4w9nC-4nzgA:
14.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4nzj PUTATIVE
ALPHA-GALACTOSIDASE


(Bacteroides
fragilis)
PF05345
(He_PIG)
PF10632
(He_PIG_assoc)
PF16499
(Melibiase_2)
3 ALA A 415
TRP A 427
VAL A 428
None
0.34A 4w9nC-4nzjA:
undetectable
4w9nC-4nzjA:
20.25
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.
4ogz PUTATIVE
ALPHA-GALACTOSIDASE/
MELIBIASE


(Bacteroides
fragilis)
PF10632
(He_PIG_assoc)
PF16499
(Melibiase_2)
PF17450
(Melibiase_2_C)
3 ALA A 415
TRP A 427
VAL A 428
None
0.37A 4w9nC-4ogzA:
undetectable
4w9nC-4ogzA:
20.42
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.
4pve POLLEN ALLERGEN PHL
P 4.0202


(Phleum pratense)
PF01565
(FAD_binding_4)
PF08031
(BBE)
3 ALA A 217
TRP A 122
VAL A 123
None
0.34A 4w9nC-4pveA:
undetectable
4w9nC-4pveA:
20.16
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.
4r7y MINICHROMOSOME
MAINTENANCE PROTEIN
MCM, CELL DIVISION
CONTROL PROTEIN 21


(Pyrococcus
furiosus;
Sulfolobus
solfataricus)
PF00493
(MCM)
PF14551
(MCM_N)
PF17207
(MCM_OB)
3 ALA A1732
TRP A1741
VAL A1742
None
0.37A 4w9nC-4r7yA:
undetectable
4w9nC-4r7yA:
20.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4rgw TRANSCRIPTION
INITIATION FACTOR
TFIID SUBUNIT 1


(Homo sapiens)
PF12157
(DUF3591)
3 ALA A 871
TRP A 883
VAL A 884
None
0.34A 4w9nC-4rgwA:
undetectable
4w9nC-4rgwA:
20.09
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4w82 FATTY ACID SYNTHASE

(Homo sapiens)
PF00107
(ADH_zinc_N)
3 ALA A1531
TRP A1546
VAL A1547
None
0.11A 4w9nC-4w82A:
22.0
4w9nC-4w82A:
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.
4z6k ALCOHOL
DEHYDROGENASE


(Moraxella sp.
TAE123)
PF00107
(ADH_zinc_N)
PF08240
(ADH_N)
3 ALA A 192
TRP A 167
VAL A 168
None
0.40A 4w9nC-4z6kA:
27.8
4w9nC-4z6kA:
25.86
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.
5a2k IG LAMBDA-1 CHAIN V
REGION S43


(Mus musculus)
PF07686
(V-set)
3 ALA H1089
TRP H1096
VAL H1097
None
0.25A 4w9nC-5a2kH:
undetectable
4w9nC-5a2kH:
22.90
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.
5az4 FLAGELLAR HOOK
SUBUNIT PROTEIN


(Campylobacter
jejuni)
PF07196
(Flagellin_IN)
PF07559
(FlaE)
3 ALA A 442
TRP A 256
VAL A 257
None
0.16A 4w9nC-5az4A:
undetectable
4w9nC-5az4A:
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.
5bnc HEME BINDING PROTEIN
MSMEG_6519


(Mycolicibacterium
smegmatis)
PF10615
(DUF2470)
PF13883
(Pyrid_oxidase_2)
3 ALA A 114
TRP A 148
VAL A 149
None
0.31A 4w9nC-5bncA:
undetectable
4w9nC-5bncA:
23.19
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.
5bqn BOTULINUM NEUROTOXIN
TYPE D,BOTULINUM
NEUROTOXIN TYPE D


(Clostridium
botulinum)
PF01742
(Peptidase_M27)
PF07952
(Toxin_trans)
3 ALA A  36
TRP A  44
VAL A  45
None
0.21A 4w9nC-5bqnA:
undetectable
4w9nC-5bqnA:
17.30
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.
5c0p ENDO-ARABINASE

(Bacteroides
thetaiotaomicron)
PF04616
(Glyco_hydro_43)
3 ALA A 261
TRP A 272
VAL A 273
None
0.33A 4w9nC-5c0pA:
undetectable
4w9nC-5c0pA:
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.
5c70 GLUCURONIDASE

(Aspergillus
oryzae)
PF00703
(Glyco_hydro_2)
PF02836
(Glyco_hydro_2_C)
PF02837
(Glyco_hydro_2_N)
3 ALA A 131
TRP A  64
VAL A  65
None
0.41A 4w9nC-5c70A:
undetectable
4w9nC-5c70A:
22.62
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.
5ejo CHROMATIN ASSEMBLY
FACTOR 1 SUBUNIT P90


(Saccharomyces
cerevisiae)
no annotation 3 ALA A 571
TRP A 584
VAL A 585
None
0.15A 4w9nC-5ejoA:
undetectable
4w9nC-5ejoA:
14.98
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.
5fcs DIABODY

(Homo sapiens)
PF07686
(V-set)
3 ALA H  91
TRP H  98
VAL H  99
None
0.30A 4w9nC-5fcsH:
undetectable
4w9nC-5fcsH:
19.02
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.
5fji BETA-GLUCOSIDASE

(Aspergillus
fumigatus)
PF00933
(Glyco_hydro_3)
PF01915
(Glyco_hydro_3_C)
PF14310
(Fn3-like)
3 ALA A 826
TRP A 835
VAL A 836
None
0.40A 4w9nC-5fjiA:
4.1
4w9nC-5fjiA:
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.
5fur TRANSCRIPTION
INITIATION FACTOR
TFIID SUBUNIT 1


(Homo sapiens)
PF12157
(DUF3591)
3 ALA G 871
TRP G 883
VAL G 884
None
0.34A 4w9nC-5furG:
undetectable
4w9nC-5furG:
10.37
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.
5hk2 SIGMA NON-OPIOID
INTRACELLULAR
RECEPTOR 1


(Homo sapiens)
PF04622
(ERG2_Sigma1R)
3 ALA A  92
TRP A  81
VAL A  82
None
0.24A 4w9nC-5hk2A:
undetectable
4w9nC-5hk2A:
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.
5i3e PUTATIVE
DEOXYRIBONUCLEASE-2


(Burkholderia
thailandensis)
PF03265
(DNase_II)
3 ALA A 311
TRP A 290
VAL A 291
None
0.31A 4w9nC-5i3eA:
undetectable
4w9nC-5i3eA:
22.69
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.
5igp MACROLIDE
2'-PHOSPHOTRANSFERAS
E


(Escherichia
coli)
PF01636
(APH)
3 ALA A  93
TRP A  49
VAL A  50
None
None
GDP  A 401 (-4.6A)
0.25A 4w9nC-5igpA:
undetectable
4w9nC-5igpA:
24.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5igu MACROLIDE
2'-PHOSPHOTRANSFERAS
E II


(Escherichia
coli)
PF01636
(APH)
3 ALA A  91
TRP A  46
VAL A  47
None
0.34A 4w9nC-5iguA:
undetectable
4w9nC-5iguA:
20.28
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.
5jbm CHROMATIN ASSEMBLY
FACTOR 1 SUBUNIT P90


(Saccharomyces
cerevisiae)
no annotation 3 ALA A 571
TRP A 584
VAL A 585
None
0.23A 4w9nC-5jbmA:
undetectable
4w9nC-5jbmA:
18.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ur2 BIFUNCTIONAL PROTEIN
PUTA


(Bdellovibrio
bacteriovorus)
PF00171
(Aldedh)
PF01619
(Pro_dh)
3 ALA A 349
TRP A 296
VAL A 297
None
0.45A 4w9nC-5ur2A:
undetectable
4w9nC-5ur2A:
16.96
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.
5uxb MACROLIDE
2'-PHOSPHOTRANSFERAS
E MPHH


(Brachybacterium
faecium)
PF01636
(APH)
3 ALA A  90
TRP A  46
VAL A  47
None
0.29A 4w9nC-5uxbA:
undetectable
4w9nC-5uxbA:
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.
5xct VL-SARAH(S37C)CHIMER
A


(Homo sapiens;
Mus musculus)
PF07686
(V-set)
PF11629
(Mst1_SARAH)
3 ALA B  89
TRP B  96
VAL B  97
None
0.17A 4w9nC-5xctB:
undetectable
4w9nC-5xctB:
19.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5xwq FUNGAL CHITINASE
FROM RHIZOMUCOR
MIEHEI (NATIVE
PROTEIN)


(Rhizomucor
miehei)
no annotation 3 ALA A 390
TRP A 377
VAL A 378
None
0.24A 4w9nC-5xwqA:
undetectable
4w9nC-5xwqA:
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.
6amz 2,3,4,5-TETRAHYDROPY
RIDINE-2,6-DICARBOXY
LATE
N-SUCCINYLTRANSFERAS
E


(Acinetobacter
baumannii)
PF00132
(Hexapep)
PF14602
(Hexapep_2)
PF14805
(THDPS_N_2)
3 ALA A  46
TRP A  53
VAL A  54
None
0.20A 4w9nC-6amzA:
undetectable
4w9nC-6amzA:
23.36
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.
6bo6 -

(-)
no annotation 3 ALA A 131
TRP A  65
VAL A  66
None
0.40A 4w9nC-6bo6A:
undetectable
4w9nC-6bo6A:
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.
6es9 ACYL-COA
DEHYDROGENASE


(Paracoccus
denitrificans)
no annotation 3 ALA A 303
TRP A 310
VAL A 311
None
0.38A 4w9nC-6es9A:
undetectable
4w9nC-6es9A:
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.
6fzw COLLAGEN
ALPHA-1(III) CHAIN


(Homo sapiens)
no annotation 3 ALA A  68
TRP A  57
VAL A  58
None
0.36A 4w9nC-6fzwA:
undetectable
4w9nC-6fzwA:
undetectable