SIMILAR PATTERNS OF AMINO ACIDS FOR 2W98_B_P1ZB1357_1

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.
1iv8 MALTOOLIGOSYL
TREHALOSE SYNTHASE

(Sulfolobus
acidocaldarius) 		PF00128
(Alpha-amylase)
PF09196
(DUF1953) 		4 TYR A 115
LEU A 100
ASN A  97
ASP A  51
 None
 1.20A 2w98A-1iv8A:
undetectable
2w98B-1iv8A:
undetectable		 2w98A-1iv8A:
19.76
2w98B-1iv8A:
19.76
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.
1kp2 ARGININOSUCCINATE
SYNTHETASE

(Escherichia
coli) 		PF00764
(Arginosuc_synth) 		4 TYR A  98
LEU A 197
ASN A 195
ASP A  48
 PO4  A 456 (-4.5A)
None
None
None
 1.39A 2w98A-1kp2A:
5.9
2w98B-1kp2A:
5.9		 2w98A-1kp2A:
23.40
2w98B-1kp2A:
23.40
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.
1olp ALPHA-TOXIN

(Clostridium
sardiniense) 		PF00882
(Zn_dep_PLPC)
PF01477
(PLAT) 		4 TYR A 192
LEU A 131
ASN A 132
LYS A 199
 None
 1.02A 2w98A-1olpA:
undetectable
2w98B-1olpA:
undetectable		 2w98A-1olpA:
21.59
2w98B-1olpA:
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.
1r47 ALPHA-GALACTOSIDASE
A

(Homo sapiens) 		PF16499
(Melibiase_2)
PF17450
(Melibiase_2_C) 		4 TYR A  86
LEU A 300
ASN A 298
ASP A 234
 None
 1.24A 2w98A-1r47A:
0.8
2w98B-1r47A:
0.8		 2w98A-1r47A:
21.54
2w98B-1r47A:
21.54
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.
1xdw NAD+-DEPENDENT
(R)-2-HYDROXYGLUTARA
TE DEHYDROGENASE

(Acidaminococcus
fermentans) 		PF00389
(2-Hacid_dh)
PF02826
(2-Hacid_dh_C) 		4 TYR A  25
LEU A  74
ASN A 316
ASP A 325
 None
 1.48A 2w98A-1xdwA:
5.2
2w98B-1xdwA:
4.1		 2w98A-1xdwA:
23.24
2w98B-1xdwA:
23.24
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.
2ogf HYPOTHETICAL PROTEIN
MJ0408

(Methanocaldococcus
jannaschii) 		PF04038
(DHNA) 		4 TYR A 115
LEU A  30
LYS A  91
ASP A  66
 None
 1.24A 2w98A-2ogfA:
undetectable
2w98B-2ogfA:
undetectable		 2w98A-2ogfA:
16.45
2w98B-2ogfA:
16.45
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.
2r09 CYTOHESIN-3

(Mus musculus) 		PF00169
(PH)
PF01369
(Sec7) 		4 TYR A 294
LEU A 310
ASN A 291
ASP A 382
 None
 1.42A 2w98A-2r09A:
undetectable
2w98B-2r09A:
undetectable		 2w98A-2r09A:
20.31
2w98B-2r09A:
20.31
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2w5s PROCESSED GLYCEROL
PHOSPHATE
LIPOTEICHOIC ACID
SYNTHASE

(Staphylococcus
aureus) 		PF00884
(Sulfatase) 		4 TYR A 417
LEU A 384
ASN A 383
ASP A 422
 None
 1.43A 2w98A-2w5sA:
undetectable
2w98B-2w5sA:
undetectable		 2w98A-2w5sA:
20.22
2w98B-2w5sA:
20.22
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.
2x05 EXO-BETA-D-GLUCOSAMI
NIDASE

(Amycolatopsis
orientalis) 		PF00703
(Glyco_hydro_2)
PF02837
(Glyco_hydro_2_N) 		4 TYR A 667
LEU A 386
ASN A 385
ASP A 378
 None
 1.40A 2w98A-2x05A:
0.0
2w98B-2x05A:
0.0		 2w98A-2x05A:
15.60
2w98B-2x05A:
15.60
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.
2x40 BETA-GLUCOSIDASE

(Thermotoga
neapolitana) 		PF00933
(Glyco_hydro_3)
PF01915
(Glyco_hydro_3_C)
PF14310
(Fn3-like) 		4 TYR A 190
LEU A 213
ASN A 211
ASP A 242
 None
None
None
GOL  A1726 (-4.0A)
 1.41A 2w98A-2x40A:
2.6
2w98B-2x40A:
undetectable		 2w98A-2x40A:
18.67
2w98B-2x40A:
18.67
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.
2xsj SULFITE REDUCTASE
ALPHA SUBUNIT

(Desulfomicrobium
norvegicum) 		PF01077
(NIR_SIR)
PF03460
(NIR_SIR_ferr) 		4 LEU A 205
ASN A 170
LYS A 215
ASP A 233
 None
None
SRM  B 503 ( 2.6A)
None
 1.31A 2w98A-2xsjA:
undetectable
2w98B-2xsjA:
undetectable		 2w98A-2xsjA:
20.70
2w98B-2xsjA:
20.70
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2zb4 PROSTAGLANDIN
REDUCTASE 2

(Homo sapiens) 		PF00107
(ADH_zinc_N)
PF16884
(ADH_N_2) 		4 LEU A 288
ASN A 291
LYS A 293
ASP A 294
 NAP  A 500 (-4.7A)
None
None
None
 0.57A 2w98A-2zb4A:
57.6
2w98B-2zb4A:
57.9		 2w98A-2zb4A:
97.49
2w98B-2zb4A:
97.49
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.
3ah5 THYMIDYLATE SYNTHASE
THYX

(Helicobacter
pylori) 		PF02511
(Thy1) 		4 TYR A  31
LEU A  78
LYS A  59
ASP A  58
 None
 1.43A 2w98A-3ah5A:
undetectable
2w98B-3ah5A:
undetectable		 2w98A-3ah5A:
19.11
2w98B-3ah5A:
19.11
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.
3few COLICIN S4

(Escherichia
coli) 		PF01024
(Colicin) 		4 TYR X 456
LEU X 474
LYS X 320
ASP X 323
 None
 1.46A 2w98A-3fewX:
undetectable
2w98B-3fewX:
undetectable		 2w98A-3fewX:
20.45
2w98B-3fewX:
20.45
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.
3fxb TRAP DICARBOXYLATE
TRANSPORTER, DCTP
SUBUNIT

(Ruegeria
pomeroyi) 		PF03480
(DctP) 		4 TYR A   5
LEU A 116
ASN A 117
ASP A 240
 None
 1.42A 2w98A-3fxbA:
undetectable
2w98B-3fxbA:
undetectable		 2w98A-3fxbA:
23.32
2w98B-3fxbA:
23.32
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.
3gs6 BETA-HEXOSAMINIDASE

(Vibrio cholerae) 		PF00933
(Glyco_hydro_3) 		4 TYR A  36
LEU A  45
ASN A  46
ASP A 111
 None
 1.14A 2w98A-3gs6A:
undetectable
2w98B-3gs6A:
undetectable		 2w98A-3gs6A:
22.33
2w98B-3gs6A:
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.
3gv5 DNA POLYMERASE IOTA

(Homo sapiens) 		PF00817
(IMS)
PF11799
(IMS_C) 		4 LEU B 205
ASN B 202
LYS B  28
ASP B 131
 None
 1.39A 2w98A-3gv5B:
undetectable
2w98B-3gv5B:
undetectable		 2w98A-3gv5B:
22.05
2w98B-3gv5B:
22.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3hje 704AA LONG
HYPOTHETICAL
GLYCOSYLTRANSFERASE

(Sulfurisphaera
tokodaii) 		PF00128
(Alpha-amylase)
PF09196
(DUF1953) 		4 TYR A 113
LEU A  98
ASN A  95
ASP A  49
 None
 1.24A 2w98A-3hjeA:
undetectable
2w98B-3hjeA:
undetectable		 2w98A-3hjeA:
19.72
2w98B-3hjeA:
19.72
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.
3or2 SULFITE REDCUTASE
SUBUNIT ALPHA

(Desulfovibrio
gigas) 		PF01077
(NIR_SIR) 		4 LEU A 205
ASN A 170
LYS A 215
ASP A 233
 None
None
SRM  A 582 ( 2.7A)
None
 1.41A 2w98A-3or2A:
undetectable
2w98B-3or2A:
undetectable		 2w98A-3or2A:
20.80
2w98B-3or2A:
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.
3prx COBRA VENOM FACTOR

(Naja kaouthia) 		PF00207
(A2M)
PF01759
(NTR)
PF01821
(ANATO)
PF01835
(A2M_N)
PF07677
(A2M_recep)
PF07678
(A2M_comp)
PF07703
(A2M_N_2)
PF10569
(Thiol-ester_cl) 		4 LYS B 753
TYR B 822
LEU B 891
LYS B 911
 None
 1.49A 2w98A-3prxB:
undetectable
2w98B-3prxB:
undetectable		 2w98A-3prxB:
13.01
2w98B-3prxB:
13.01
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.
3rru TOM1L1 PROTEIN

(Homo sapiens) 		PF00790
(VHS) 		4 TYR A 143
LEU A 120
ASN A 121
ASP A  77
 None
 1.38A 2w98A-3rruA:
undetectable
2w98B-3rruA:
undetectable		 2w98A-3rruA:
18.99
2w98B-3rruA:
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.
3uxf FIMBRIAL SUBUNIT
TYPE 1

(Actinomyces
oris) 		no annotation 4 TYR A 447
LEU A 471
LYS A 439
ASP A 440
 None
 1.45A 2w98A-3uxfA:
undetectable
2w98B-3uxfA:
undetectable		 2w98A-3uxfA:
21.05
2w98B-3uxfA:
21.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3zgb PHOSPHOENOLPYRUVATE
CARBOXYLASE

(Flaveria
pringlei) 		PF00311
(PEPcase) 		4 TYR A  33
LEU A 212
LYS A 205
ASP A 204
 None
 1.20A 2w98A-3zgbA:
undetectable
2w98B-3zgbA:
undetectable		 2w98A-3zgbA:
16.89
2w98B-3zgbA:
16.89
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.
4arv PHYTASE

(Yersinia
kristensenii) 		PF00328
(His_Phos_2) 		4 LYS A 261
LEU A 323
ASN A 329
ASP A 307
 None
None
None
PO4  A1415 (-2.8A)
 1.36A 2w98A-4arvA:
undetectable
2w98B-4arvA:
undetectable		 2w98A-4arvA:
22.57
2w98B-4arvA:
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.
4c30 DNA HELICASE II

(Deinococcus
radiodurans) 		PF00580
(UvrD-helicase)
PF13361
(UvrD_C) 		4 LYS A  38
TYR A 612
LEU A 297
ASN A 289
 ANP  A1662 (-2.9A)
None
None
None
 1.37A 2w98A-4c30A:
5.0
2w98B-4c30A:
5.2		 2w98A-4c30A:
18.93
2w98B-4c30A:
18.93
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.
4f4w DNA POLYMERASE IV

(Sulfolobus
acidocaldarius;
Sulfolobus
solfataricus) 		PF00817
(IMS)
PF11798
(IMS_HHH) 		4 LEU A 151
ASN A 148
LYS A   1
ASP A 110
 None
 1.33A 2w98A-4f4wA:
undetectable
2w98B-4f4wA:
undetectable		 2w98A-4f4wA:
23.06
2w98B-4f4wA:
23.06
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4fyp VEGETATIVE STORAGE
PROTEIN 1

(Arabidopsis
thaliana) 		PF03767
(Acid_phosphat_B) 		4 LYS A 260
TYR A  86
LEU A 265
ASP A 124
 None
None
None
MG  A 301 (-2.5A)
 1.29A 2w98A-4fypA:
4.4
2w98B-4fypA:
4.4		 2w98A-4fypA:
22.55
2w98B-4fypA:
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.
4fyp VEGETATIVE STORAGE
PROTEIN 1

(Arabidopsis
thaliana) 		PF03767
(Acid_phosphat_B) 		4 TYR A  86
LEU A 265
ASN A 263
ASP A 124
 None
None
None
MG  A 301 (-2.5A)
 1.34A 2w98A-4fypA:
4.4
2w98B-4fypA:
4.4		 2w98A-4fypA:
22.55
2w98B-4fypA:
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.
4gom DNA ADENINE
METHYLASE

(Escherichia
coli) 		PF02086
(MethyltransfD12) 		4 TYR D  50
LEU D  43
ASN D  44
ASP D  19
 None
 1.49A 2w98A-4gomD:
4.1
2w98B-4gomD:
3.3		 2w98A-4gomD:
20.87
2w98B-4gomD:
20.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4hyk DNA POLYMERASE IV

(Sulfolobus
acidocaldarius) 		PF00817
(IMS)
PF11798
(IMS_HHH) 		4 LEU A 151
ASN A 148
LYS A   1
ASP A 110
 None
 1.34A 2w98A-4hykA:
undetectable
2w98B-4hykA:
undetectable		 2w98A-4hykA:
23.12
2w98B-4hykA:
23.12
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.
4i8v CYTOCHROME P450 1A1

(Homo sapiens) 		PF00067
(p450) 		4 TYR A 189
LEU A 215
ASN A 219
ASP A 320
 None
None
None
BHF  A 602 (-3.7A)
 1.26A 2w98A-4i8vA:
undetectable
2w98B-4i8vA:
undetectable		 2w98A-4i8vA:
21.38
2w98B-4i8vA:
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.
4j7h EVAA 2,3-DEHYDRATASE

(Amycolatopsis
orientalis) 		PF03559
(Hexose_dehydrat) 		4 LEU A 145
ASN A  52
LYS A 137
ASP A 216
 None
None
TLO  A 501 ( 4.8A)
None
 1.38A 2w98A-4j7hA:
undetectable
2w98B-4j7hA:
undetectable		 2w98A-4j7hA:
22.33
2w98B-4j7hA:
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.
4kc5 RHIE PROTEIN

(Paraburkholderia
rhizoxinica) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C) 		4 TYR A3861
LEU A3660
ASN A3664
ASP A3686
 None
 1.47A 2w98A-4kc5A:
undetectable
2w98B-4kc5A:
undetectable		 2w98A-4kc5A:
17.42
2w98B-4kc5A:
17.42
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.
4lvq PHOSPHATE-BINDING
PROTEIN PSTS 3

(Mycobacterium
tuberculosis) 		PF12849
(PBP_like_2) 		4 TYR A 315
LEU A 312
ASN A 196
LYS A 215
 None
 1.36A 2w98A-4lvqA:
undetectable
2w98B-4lvqA:
undetectable		 2w98A-4lvqA:
22.77
2w98B-4lvqA:
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.
4n5q TRANSIENT RECEPTOR
POTENTIAL CATION
CHANNEL SUBFAMILY V
MEMBER 3

(Mus musculus) 		PF00023
(Ank)
PF12796
(Ank_2) 		4 TYR A 321
LEU A 333
ASN A 298
ASP A 293
 None
 1.46A 2w98A-4n5qA:
undetectable
2w98B-4n5qA:
undetectable		 2w98A-4n5qA:
22.53
2w98B-4n5qA:
22.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4rkc AROMATIC AMINO ACID
AMINOTRANSFERASE

(Psychrobacter
sp. B6) 		PF00155
(Aminotran_1_2) 		4 TYR A  37
LEU A  31
LYS A  28
ASP A  23
 None
 1.31A 2w98A-4rkcA:
3.2
2w98B-4rkcA:
undetectable		 2w98A-4rkcA:
22.73
2w98B-4rkcA:
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.
5abj VP3
VP4

(Enterovirus A) 		PF00073
(Rhv)
PF02226
(Pico_P1A) 		4 TYR C 108
LEU C  44
ASN C  42
ASP D  45
 None
 1.12A 2w98A-5abjC:
undetectable
2w98B-5abjC:
undetectable		 2w98A-5abjC:
20.16
2w98B-5abjC:
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.
5bnn CAPSID PROTEIN VP3
CAPSID PROTEIN VP4

(Enterovirus D) 		PF00073
(Rhv)
PF02226
(Pico_P1A) 		4 TYR C 106
LEU C  44
ASN C  42
ASP D  44
 None
 1.36A 2w98A-5bnnC:
undetectable
2w98B-5bnnC:
undetectable		 2w98A-5bnnC:
20.66
2w98B-5bnnC:
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.
5eaw DNA REPLICATION
ATP-DEPENDENT
HELICASE/NUCLEASE
DNA2

(Mus musculus) 		PF08696
(Dna2)
PF13086
(AAA_11)
PF13087
(AAA_12) 		4 LEU A 451
ASN A 798
LYS A 456
ASP A 457
 None
 1.23A 2w98A-5eawA:
2.7
2w98B-5eawA:
3.7		 2w98A-5eawA:
16.40
2w98B-5eawA:
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.
5ioj HALOALKYLPHOSPHORUS
HYDROLASE

(Sphingobium sp.
TCM1) 		no annotation 4 LEU A 243
ASN A 241
LYS A 246
ASP A 238
 None
 1.38A 2w98A-5iojA:
undetectable
2w98B-5iojA:
undetectable		 2w98A-5iojA:
22.04
2w98B-5iojA:
22.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5kt0 4-HYDROXY-TETRAHYDRO
DIPICOLINATE
REDUCTASE

(Trichormus
variabilis) 		PF01113
(DapB_N)
PF05173
(DapB_C) 		4 LEU A  68
ASN A  66
LYS A  38
ASP A  64
 None
 1.34A 2w98A-5kt0A:
6.9
2w98B-5kt0A:
7.0		 2w98A-5kt0A:
22.66
2w98B-5kt0A:
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.
5olc GALACTONATE
DEHYDRATASE

(Zobellia
galactanivorans) 		no annotation 4 TYR A 289
LEU A 257
LYS A 232
ASP A 229
 None
 1.45A 2w98A-5olcA:
undetectable
2w98B-5olcA:
undetectable		 2w98A-5olcA:
11.14
2w98B-5olcA:
11.14
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.
5weg UTP--GLUCOSE-1-PHOSP
HATE
URIDYLYLTRANSFERASE

(Saccharum
hybrid cultivar) 		no annotation 4 TYR A 157
LEU A 140
ASN A  93
ASP A 229
 None
 1.36A 2w98A-5wegA:
undetectable
2w98B-5wegA:
1.9		 2w98A-5wegA:
13.21
2w98B-5wegA:
13.21
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.
5x2g CRISPR-ASSOCIATED
ENDONUCLEASE CAS9

(Campylobacter
jejuni) 		no annotation 4 LEU A 261
ASN A 353
LYS A 357
ASP A 358
 None
 1.48A 2w98A-5x2gA:
undetectable
2w98B-5x2gA:
undetectable		 2w98A-5x2gA:
16.85
2w98B-5x2gA:
16.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5xya -

(-) 		no annotation 4 TYR A 385
LEU A 401
ASN A 351
ASP A 587
 None
 1.43A 2w98A-5xyaA:
undetectable
2w98B-5xyaA:
undetectable		 2w98A-5xyaA:
undetectable
2w98B-5xyaA:
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.
6cet GATOR COMPLEX
PROTEIN DEPDC5

(Homo sapiens) 		no annotation 4 LYS D 411
LEU D 271
ASN D 197
ASP D 189
 None
 1.45A 2w98A-6cetD:
undetectable
2w98B-6cetD:
undetectable		 2w98A-6cetD:
11.20
2w98B-6cetD:
11.20
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.
6f0k FE-S-CLUSTER-CONTAIN
ING HYDROGENASE

(Rhodothermus
marinus) 		no annotation 4 TYR B 725
LEU B 644
ASN B 605
ASP B 577
 None
 1.45A 2w98A-6f0kB:
undetectable
2w98B-6f0kB:
undetectable		 2w98A-6f0kB:
11.61
2w98B-6f0kB:
11.61
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.
6f0k FE-S-CLUSTER-CONTAIN
ING HYDROGENASE

(Rhodothermus
marinus) 		no annotation 4 TYR B 725
LEU B 644
ASN B 605
ASP B 596
 None
 1.43A 2w98A-6f0kB:
undetectable
2w98B-6f0kB:
undetectable		 2w98A-6f0kB:
11.61
2w98B-6f0kB:
11.61