SIMILAR PATTERNS OF AMINO ACIDS FOR 4X3U_B_SVRB102_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.
1e33 ARYLSULFATASE A

(Homo sapiens) 		PF00884
(Sulfatase)
PF14707
(Sulfatase_C) 		3 LYS P 463
ARG P  84
VAL P  83
 None
 0.97A 4x3uA-1e33P:
1.6
4x3uB-1e33P:
1.2		 4x3uA-1e33P:
7.98
4x3uB-1e33P:
7.98
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.
1i1q ANTHRANILATE
SYNTHASE COMPONENT I

(Salmonella
enterica) 		PF00425
(Chorismate_bind)
PF04715
(Anth_synt_I_N) 		3 LYS A  46
ARG A 332
VAL A 396
 None
 0.81A 4x3uA-1i1qA:
undetectable
4x3uB-1i1qA:
0.0		 4x3uA-1i1qA:
8.75
4x3uB-1i1qA:
8.75
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.
1j31 HYPOTHETICAL PROTEIN
PH0642

(Pyrococcus
horikoshii) 		PF00795
(CN_hydrolase) 		3 LYS A 113
ARG A  53
VAL A 122
 None
 0.93A 4x3uA-1j31A:
0.0
4x3uB-1j31A:
0.0		 4x3uA-1j31A:
13.89
4x3uB-1j31A:
13.89
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.
1jjf ENDO-1,4-BETA-XYLANA
SE Z

(Ruminiclostridium
thermocellum) 		PF00756
(Esterase) 		3 LYS A 266
ARG A  43
VAL A  42
 None
 1.02A 4x3uA-1jjfA:
0.0
4x3uB-1jjfA:
0.0		 4x3uA-1jjfA:
14.88
4x3uB-1jjfA:
14.88
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.
1lml LEISHMANOLYSIN

(Leishmania
major) 		PF01457
(Peptidase_M8) 		3 LYS A 152
ARG A 127
VAL A 128
 None
 1.00A 4x3uA-1lmlA:
undetectable
4x3uB-1lmlA:
undetectable		 4x3uA-1lmlA:
10.71
4x3uB-1lmlA:
10.71
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.
1s6r BETA-LACTAMASE

(Enterobacter
cloacae) 		PF00144
(Beta-lactamase) 		3 LYS A 290
ARG A 349
VAL A 350
 None
 1.04A 4x3uA-1s6rA:
0.0
4x3uB-1s6rA:
0.0		 4x3uA-1s6rA:
10.00
4x3uB-1s6rA:
10.00
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.
1u0t INORGANIC
POLYPHOSPHATE/ATP-NA
D KINASE

(Mycobacterium
tuberculosis) 		PF01513
(NAD_kinase) 		3 LYS A 280
ARG A 274
VAL A 276
 None
 1.03A 4x3uA-1u0tA:
undetectable
4x3uB-1u0tA:
0.0		 4x3uA-1u0tA:
15.77
4x3uB-1u0tA:
15.77
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.
1u5g SRC-ASSOCIATED
ADAPTOR PROTEIN

(Mus musculus) 		PF00169
(PH) 		3 LYS A 194
ARG A 172
VAL A 171
 None
 0.79A 4x3uA-1u5gA:
0.5
4x3uB-1u5gA:
0.6		 4x3uA-1u5gA:
19.67
4x3uB-1u5gA:
19.67
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.
2c11 MEMBRANE COPPER
AMINE OXIDASE

(Homo sapiens) 		PF01179
(Cu_amine_oxid)
PF02727
(Cu_amine_oxidN2)
PF02728
(Cu_amine_oxidN3) 		3 LYS A 106
ARG A 353
VAL A 352
 CA  A1736 ( 3.7A)
None
None
 1.03A 4x3uA-2c11A:
0.7
4x3uB-2c11A:
0.6		 4x3uA-2c11A:
6.68
4x3uB-2c11A:
6.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ghs AGR_C_1268P

(Agrobacterium
fabrum) 		PF08450
(SGL) 		3 LYS A  71
ARG A  29
VAL A  30
 None
 0.61A 4x3uA-2ghsA:
undetectable
4x3uB-2ghsA:
undetectable		 4x3uA-2ghsA:
12.00
4x3uB-2ghsA:
12.00
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.
2hma PROBABLE TRNA
(5-METHYLAMINOMETHYL
-2-THIOURIDYLATE)-ME
THYLTRANSFERASE

(Streptococcus
pneumoniae) 		PF03054
(tRNA_Me_trans) 		3 LYS A   2
ARG A   8
VAL A  33
 None
 1.00A 4x3uA-2hmaA:
undetectable
4x3uB-2hmaA:
undetectable		 4x3uA-2hmaA:
10.11
4x3uB-2hmaA:
10.11
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.
2hne L-FUCONATE
DEHYDRATASE

(Xanthomonas
campestris) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		3 LYS A 218
ARG A 347
VAL A 348
 MG  A 601 ( 3.7A)
None
None
 0.81A 4x3uA-2hneA:
undetectable
4x3uB-2hneA:
undetectable		 4x3uA-2hneA:
9.88
4x3uB-2hneA:
9.88
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.
2mu0 ARSENATE REDUCTASE

(Brucella
abortus) 		PF03960
(ArsC) 		3 LYS A  82
ARG A 124
VAL A 132
 None
 0.71A 4x3uA-2mu0A:
undetectable
4x3uB-2mu0A:
undetectable		 4x3uA-2mu0A:
25.51
4x3uB-2mu0A:
25.51
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.
2oxt NUCLEOSIDE-2'-O-METH
YLTRANSFERASE

(Meaban virus) 		PF01728
(FtsJ) 		3 LYS A 173
ARG A 102
VAL A  78
 None
 0.91A 4x3uA-2oxtA:
undetectable
4x3uB-2oxtA:
undetectable		 4x3uA-2oxtA:
16.13
4x3uB-2oxtA:
16.13
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.
2poz PUTATIVE DEHYDRATASE

(Mesorhizobium
japonicum) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		3 LYS A 157
ARG A 303
VAL A 304
 None
 0.75A 4x3uA-2pozA:
undetectable
4x3uB-2pozA:
undetectable		 4x3uA-2pozA:
10.24
4x3uB-2pozA:
10.24
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.
2qm1 GLUCOKINASE

(Enterococcus
faecalis) 		PF00480
(ROK) 		3 LYS A 180
ARG A 195
VAL A 187
 ZN  A1002 ( 4.5A)
None
None
 0.94A 4x3uA-2qm1A:
undetectable
4x3uB-2qm1A:
undetectable		 4x3uA-2qm1A:
12.50
4x3uB-2qm1A:
12.50
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.
2qz6 BETA-LACTAMASE

(Pseudomonas
fluorescens) 		PF00144
(Beta-lactamase) 		3 LYS A  48
ARG A 211
VAL A 210
 None
 1.06A 4x3uA-2qz6A:
undetectable
4x3uB-2qz6A:
undetectable		 4x3uA-2qz6A:
11.21
4x3uB-2qz6A:
11.21
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.
2r94 2-KETO-3-DEOXY-(6-PH
OSPHO-)GLUCONATE
ALDOLASE

(Thermoproteus
tenax) 		PF00701
(DHDPS) 		3 LYS A 173
ARG A  86
VAL A  87
 PYR  A 999 (-1.5A)
None
None
 1.04A 4x3uA-2r94A:
undetectable
4x3uB-2r94A:
undetectable		 4x3uA-2r94A:
12.93
4x3uB-2r94A:
12.93
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.
2uwi CRME PROTEIN

(Vaccinia virus) 		PF00020
(TNFR_c6) 		3 LYS A 124
ARG A  87
VAL A  88
 None
 0.83A 4x3uA-2uwiA:
undetectable
4x3uB-2uwiA:
undetectable		 4x3uA-2uwiA:
17.83
4x3uB-2uwiA:
17.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2w01 ADENYLATE CYCLASE

(Synechocystis
sp. PCC 6803) 		PF00211
(Guanylate_cyc) 		3 LYS A 435
ARG A 439
VAL A 548
 None
 1.03A 4x3uA-2w01A:
undetectable
4x3uB-2w01A:
undetectable		 4x3uA-2w01A:
13.99
4x3uB-2w01A:
13.99
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.
2yzm D-ALANINE--D-ALANINE
LIGASE

(Thermus
thermophilus) 		PF01820
(Dala_Dala_lig_N)
PF07478
(Dala_Dala_lig_C) 		3 LYS A 120
ARG A 137
VAL A 136
 None
 0.75A 4x3uA-2yzmA:
undetectable
4x3uB-2yzmA:
undetectable		 4x3uA-2yzmA:
13.57
4x3uB-2yzmA:
13.57
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.
3atb POTASSIUM
INWARDLY-RECTIFYING
CHANNEL, SUBFAMILY
J, MEMBER 6

(Mus musculus) 		PF01007
(IRK) 		3 LYS A 202
ARG A  73
VAL A  72
 None
 0.91A 4x3uA-3atbA:
undetectable
4x3uB-3atbA:
undetectable		 4x3uA-3atbA:
18.36
4x3uB-3atbA:
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.
3axy PROTEIN HEADING DATE
3A

(Oryza sativa) 		PF01161
(PBP) 		3 LYS A   5
ARG A  15
VAL A  16
 None
 1.05A 4x3uA-3axyA:
undetectable
4x3uB-3axyA:
undetectable		 4x3uA-3axyA:
15.79
4x3uB-3axyA:
15.79
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.
3bn1 PEROSAMINE
SYNTHETASE

(Caulobacter
vibrioides) 		PF01041
(DegT_DnrJ_EryC1) 		3 LYS A 187
ARG A 256
VAL A 257
 LLP  A 186 ( 2.9A)
None
None
 1.00A 4x3uA-3bn1A:
undetectable
4x3uB-3bn1A:
undetectable		 4x3uA-3bn1A:
9.56
4x3uB-3bn1A:
9.56
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.
3f2b DNA-DIRECTED DNA
POLYMERASE III ALPHA
CHAIN

(Geobacillus
kaustophilus) 		PF02811
(PHP)
PF07733
(DNA_pol3_alpha)
PF14579
(HHH_6) 		3 LYS A 953
ARG A1285
VAL A1284
 None
 0.90A 4x3uA-3f2bA:
undetectable
4x3uB-3f2bA:
undetectable		 4x3uA-3f2bA:
5.62
4x3uB-3f2bA:
5.62
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.
3gn6 CT0912, ORFAN
PROTEIN WITH A
FERREDOXIN-LIKE
DOMAIN REPEAT

(Chlorobaculum
tepidum) 		no annotation 3 LYS A 153
ARG A  46
VAL A  47
 None
GOL  A 324 (-3.6A)
None
 0.85A 4x3uA-3gn6A:
undetectable
4x3uB-3gn6A:
undetectable		 4x3uA-3gn6A:
10.94
4x3uB-3gn6A:
10.94
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.
3hkz DNA-DIRECTED RNA
POLYMERASE SUBUNIT B

(Sulfolobus
solfataricus) 		PF00562
(RNA_pol_Rpb2_6)
PF04560
(RNA_pol_Rpb2_7)
PF04561
(RNA_pol_Rpb2_2)
PF04563
(RNA_pol_Rpb2_1)
PF04565
(RNA_pol_Rpb2_3)
PF04566
(RNA_pol_Rpb2_4)
PF04567
(RNA_pol_Rpb2_5) 		3 LYS B 519
ARG B 171
VAL B 172
 None
 0.83A 4x3uA-3hkzB:
undetectable
4x3uB-3hkzB:
undetectable		 4x3uA-3hkzB:
4.25
4x3uB-3hkzB:
4.25
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.
3ibr BACTERIOPHYTOCHROME

(Pseudomonas
aeruginosa) 		PF00360
(PHY)
PF01590
(GAF)
PF08446
(PAS_2) 		3 LYS A 282
ARG A 159
VAL A 160
 None
 0.92A 4x3uA-3ibrA:
undetectable
4x3uB-3ibrA:
undetectable		 4x3uA-3ibrA:
8.24
4x3uB-3ibrA:
8.24
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.
3ivu HOMOCITRATE
SYNTHASE,
MITOCHONDRIAL

(Schizosaccharomyces
pombe) 		PF00682
(HMGL-like) 		3 LYS A 156
ARG A 191
VAL A 192
 None
 0.66A 4x3uA-3ivuA:
undetectable
4x3uB-3ivuA:
undetectable		 4x3uA-3ivuA:
10.40
4x3uB-3ivuA:
10.40
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.
3j09 COPPER-EXPORTING
P-TYPE ATPASE A

(Archaeoglobus
fulgidus) 		PF00122
(E1-E2_ATPase)
PF00403
(HMA)
PF00702
(Hydrolase) 		3 LYS A 470
ARG A  48
VAL A  49
 None
 1.02A 4x3uA-3j09A:
undetectable
4x3uB-3j09A:
undetectable		 4x3uA-3j09A:
7.28
4x3uB-3j09A:
7.28
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.
3k7h INDIAN HEDGEHOG
PROTEIN

(Homo sapiens) 		PF01085
(HH_signal) 		3 LYS B  95
ARG B 128
VAL B 129
 None
SO4  B   1 (-3.0A)
None
 1.04A 4x3uA-3k7hB:
undetectable
4x3uB-3k7hB:
undetectable		 4x3uA-3k7hB:
17.22
4x3uB-3k7hB:
17.22
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.
3kom TRANSKETOLASE

(Francisella
tularensis) 		PF00456
(Transketolase_N)
PF02779
(Transket_pyr)
PF02780
(Transketolase_C) 		3 LYS A 505
ARG A 327
VAL A 335
 None
 0.87A 4x3uA-3komA:
undetectable
4x3uB-3komA:
undetectable		 4x3uA-3komA:
7.68
4x3uB-3komA:
7.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3kyl TELOMERASE REVERSE
TRANSCRIPTASE

(Tribolium
castaneum) 		PF00078
(RVT_1)
PF12009
(Telomerase_RBD) 		3 LYS A 406
ARG A 402
VAL A 401
 None
 0.88A 4x3uA-3kylA:
undetectable
4x3uB-3kylA:
undetectable		 4x3uA-3kylA:
6.90
4x3uB-3kylA:
6.90
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.
3l7v PUTATIVE
UNCHARACTERIZED
PROTEIN SMU.1377C

(Streptococcus
mutans) 		PF01300
(Sua5_yciO_yrdC) 		3 LYS A  31
ARG A 234
VAL A 204
 None
SO4  A 262 ( 3.5A)
None
 1.06A 4x3uA-3l7vA:
undetectable
4x3uB-3l7vA:
undetectable		 4x3uA-3l7vA:
14.71
4x3uB-3l7vA:
14.71
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.
3mbr GLUTAMINE
CYCLOTRANSFERASE

(Xanthomonas
campestris) 		PF05096
(Glu_cyclase_2) 		3 LYS X 244
ARG X  79
VAL X  66
 None
 0.98A 4x3uA-3mbrX:
undetectable
4x3uB-3mbrX:
undetectable		 4x3uA-3mbrX:
12.97
4x3uB-3mbrX:
12.97
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.
3mm5 SULFITE REDUCTASE,
DISSIMILATORY-TYPE
SUBUNIT ALPHA
SULFITE REDUCTASE,
DISSIMILATORY-TYPE
SUBUNIT BETA

(Archaeoglobus
fulgidus) 		PF00037
(Fer4)
PF01077
(NIR_SIR)
PF03460
(NIR_SIR_ferr) 		3 LYS A 300
ARG B  43
VAL B  44
 None
SRM  B 570 (-2.5A)
None
 0.96A 4x3uA-3mm5A:
undetectable
4x3uB-3mm5A:
undetectable		 4x3uA-3mm5A:
8.61
4x3uB-3mm5A:
8.61
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.
3n40 P62 ENVELOPE
GLYCOPROTEIN

(Chikungunya
virus) 		PF00943
(Alpha_E2_glycop)
PF01563
(Alpha_E3_glycop) 		3 LYS P 297
ARG P 262
VAL P 261
 None
 0.96A 4x3uA-3n40P:
undetectable
4x3uB-3n40P:
undetectable		 4x3uA-3n40P:
8.98
4x3uB-3n40P:
8.98
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.
3nn2 CHLORITE DISMUTASE

(Nitrospira
defluvii) 		PF06778
(Chlor_dismutase) 		3 LYS A   1
ARG A  70
VAL A  71
 None
 0.65A 4x3uA-3nn2A:
undetectable
4x3uB-3nn2A:
undetectable		 4x3uA-3nn2A:
13.93
4x3uB-3nn2A:
13.93
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.
3p9n POSSIBLE
METHYLTRANSFERASE
(METHYLASE)

(Mycobacterium
tuberculosis) 		PF03602
(Cons_hypoth95) 		3 LYS A  25
ARG A 171
VAL A 172
 None
 0.70A 4x3uA-3p9nA:
undetectable
4x3uB-3p9nA:
undetectable		 4x3uA-3p9nA:
16.02
4x3uB-3p9nA:
16.02
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.
3q1t ENOYL-COA HYDRATASE

(Mycobacterium
avium) 		PF00378
(ECH_1) 		3 LYS A 223
ARG A  61
VAL A  60
 None
 1.02A 4x3uA-3q1tA:
undetectable
4x3uB-3q1tA:
undetectable		 4x3uA-3q1tA:
13.01
4x3uB-3q1tA:
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.
3qac 11S GLOBULIN SEED
STORAGE PROTEIN

(Amaranthus
hypochondriacus) 		PF00190
(Cupin_1) 		3 LYS A 388
ARG A 352
VAL A 351
 None
 1.03A 4x3uA-3qacA:
undetectable
4x3uB-3qacA:
undetectable		 4x3uA-3qacA:
10.78
4x3uB-3qacA:
10.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3qgh RNA-DIRECTED RNA
POLYMERASE

(Hepacivirus C) 		PF00998
(RdRP_3) 		3 LYS A 141
ARG A 168
VAL A 284
 None
 1.03A 4x3uA-3qghA:
undetectable
4x3uB-3qghA:
undetectable		 4x3uA-3qghA:
8.12
4x3uB-3qghA:
8.12
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.
3qxz ENOYL-COA
HYDRATASE/ISOMERASE

(Mycobacteroides
abscessus) 		PF00378
(ECH_1) 		3 LYS A 209
ARG A  49
VAL A  48
 None
EDO  A 266 (-4.5A)
K  A 262 ( 4.3A)
 0.95A 4x3uA-3qxzA:
undetectable
4x3uB-3qxzA:
undetectable		 4x3uA-3qxzA:
13.10
4x3uB-3qxzA:
13.10
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.
3v8x TRANSFERRIN-BINDING
PROTEIN 1

(Neisseria
meningitidis) 		PF00593
(TonB_dep_Rec)
PF07715
(Plug) 		3 LYS A 467
ARG A 470
VAL A 471
 None
 0.76A 4x3uA-3v8xA:
undetectable
4x3uB-3v8xA:
undetectable		 4x3uA-3v8xA:
5.28
4x3uB-3v8xA:
5.28
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.
3vpx LEUCINE
DEHYDROGENASE

(Sporosarcina
psychrophila) 		PF00208
(ELFV_dehydrog)
PF02812
(ELFV_dehydrog_N) 		3 LYS A  68
ARG A 309
VAL A 310
 None
 0.73A 4x3uA-3vpxA:
undetectable
4x3uB-3vpxA:
undetectable		 4x3uA-3vpxA:
10.84
4x3uB-3vpxA:
10.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3wd8 TYPE III POLYKETIDE
SYNTHASE QUINOLONE
SYNTHASE

(Citrus x
microcarpa) 		PF00195
(Chal_sti_synt_N)
PF02797
(Chal_sti_synt_C) 		3 LYS A  11
ARG A 185
VAL A 186
 None
 0.98A 4x3uA-3wd8A:
undetectable
4x3uB-3wd8A:
undetectable		 4x3uA-3wd8A:
11.19
4x3uB-3wd8A:
11.19
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.
3x0y DSZC

(Rhodococcus
erythropolis) 		PF02770
(Acyl-CoA_dh_M)
PF02771
(Acyl-CoA_dh_N)
PF08028
(Acyl-CoA_dh_2) 		3 LYS A 349
ARG A  81
VAL A  80
 None
 1.08A 4x3uA-3x0yA:
undetectable
4x3uB-3x0yA:
undetectable		 4x3uA-3x0yA:
9.02
4x3uB-3x0yA:
9.02
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.
4dou ADIPONECTIN

(Homo sapiens) 		PF00386
(C1q) 		3 LYS A 407
ARG A 503
VAL A 453
 None
 0.62A 4x3uA-4douA:
undetectable
4x3uB-4douA:
undetectable		 4x3uA-4douA:
8.41
4x3uB-4douA:
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.
4gj1 1-(5-PHOSPHORIBOSYL)
-5-[(5-PHOSPHORIBOSY
LAMINO)METHYLIDENEAM
INO]
IMIDAZOLE-4-CARBOXAM
IDE ISOMERASE

(Campylobacter
jejuni) 		PF00977
(His_biosynth) 		3 LYS A 181
ARG A  17
VAL A  19
 None
 1.05A 4x3uA-4gj1A:
undetectable
4x3uB-4gj1A:
undetectable		 4x3uA-4gj1A:
13.22
4x3uB-4gj1A:
13.22
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.
4iyj GDSL-LIKE PROTEIN

(Bacteroides
uniformis) 		PF13472
(Lipase_GDSL_2) 		3 LYS A  43
ARG A  75
VAL A  93
 None
 0.98A 4x3uA-4iyjA:
undetectable
4x3uB-4iyjA:
undetectable		 4x3uA-4iyjA:
21.14
4x3uB-4iyjA:
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.
4kf5 FLUORESCENT PROTEIN
SFCHERRY+GFP10-11

(synthetic
construct) 		PF01353
(GFP) 		3 LYS C 222
ARG C  95
VAL C  96
 None
CH6  C  66 ( 2.5A)
None
 0.77A 4x3uA-4kf5C:
undetectable
4x3uB-4kf5C:
undetectable		 4x3uA-4kf5C:
16.81
4x3uB-4kf5C:
16.81
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.
4krf PROTEIN ARGONAUTE-1

(Homo sapiens) 		PF02170
(PAZ)
PF02171
(Piwi)
PF08699
(ArgoL1)
PF16486
(ArgoN)
PF16487
(ArgoMid)
PF16488
(ArgoL2) 		3 LYS A 352
ARG A 278
VAL A 279
 None
 0.97A 4x3uA-4krfA:
undetectable
4x3uB-4krfA:
undetectable		 4x3uA-4krfA:
5.64
4x3uB-4krfA:
5.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4n0g ABSCISIC ACID
RECEPTOR PYL13

(Arabidopsis
thaliana) 		PF10604
(Polyketide_cyc2) 		3 LYS C 105
ARG C  63
VAL C  62
 None
 1.05A 4x3uA-4n0gC:
undetectable
4x3uB-4n0gC:
undetectable		 4x3uA-4n0gC:
18.99
4x3uB-4n0gC:
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.
4pc7 ELONGATION FACTOR TS

(Escherichia
coli) 		PF00889
(EF_TS) 		3 LYS C  51
ARG C 132
VAL C 260
 None
 1.05A 4x3uA-4pc7C:
undetectable
4x3uB-4pc7C:
undetectable		 4x3uA-4pc7C:
14.40
4x3uB-4pc7C:
14.40
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.
4pj3 INTRON-BINDING
PROTEIN AQUARIUS

(Homo sapiens) 		PF13086
(AAA_11)
PF13087
(AAA_12)
PF16399
(Aquarius_N) 		3 LYS A 101
ARG A1288
VAL A1287
 None
 1.05A 4x3uA-4pj3A:
undetectable
4x3uB-4pj3A:
undetectable		 4x3uA-4pj3A:
4.24
4x3uB-4pj3A:
4.24
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.
4qhr ALANINE RACEMASE

(Acinetobacter
baumannii) 		PF00842
(Ala_racemase_C)
PF01168
(Ala_racemase_N) 		3 LYS A 181
ARG A 209
VAL A 208
 None
LLP  A  34 ( 3.9A)
None
 1.05A 4x3uA-4qhrA:
0.3
4x3uB-4qhrA:
0.6		 4x3uA-4qhrA:
10.67
4x3uB-4qhrA:
10.67
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.
4qiw DNA-DIRECTED RNA
POLYMERASE

(Thermococcus
kodakarensis) 		PF00562
(RNA_pol_Rpb2_6)
PF04560
(RNA_pol_Rpb2_7)
PF04561
(RNA_pol_Rpb2_2)
PF04563
(RNA_pol_Rpb2_1)
PF04565
(RNA_pol_Rpb2_3)
PF04566
(RNA_pol_Rpb2_4)
PF04567
(RNA_pol_Rpb2_5) 		3 LYS B 340
ARG B 335
VAL B 327
 None
 1.04A 4x3uA-4qiwB:
undetectable
4x3uB-4qiwB:
undetectable		 4x3uA-4qiwB:
4.90
4x3uB-4qiwB:
4.90
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.
4u4h TEGUMENT PROTEIN
UL21

(Human
alphaherpesvirus
1) 		PF03252
(Herpes_UL21) 		3 LYS A  49
ARG A  55
VAL A  54
 None
 0.77A 4x3uA-4u4hA:
undetectable
4x3uB-4u4hA:
undetectable		 4x3uA-4u4hA:
18.37
4x3uB-4u4hA:
18.37
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.
4w82 FATTY ACID SYNTHASE

(Homo sapiens) 		PF00107
(ADH_zinc_N) 		3 LYS A1851
ARG A1824
VAL A1823
 None
 0.74A 4x3uA-4w82A:
undetectable
4x3uB-4w82A:
undetectable		 4x3uA-4w82A:
11.25
4x3uB-4w82A:
11.25
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.
4w99 ENOYL-[ACYL-CARRIER-
PROTEIN] REDUCTASE
[NADPH, B-SPECIFIC]
1, MITOCHONDRIAL

(Candida
tropicalis) 		no annotation 3 LYS A  85
ARG A 133
VAL A  29
 None
 1.07A 4x3uA-4w99A:
undetectable
4x3uB-4w99A:
undetectable		 4x3uA-4w99A:
10.20
4x3uB-4w99A:
10.20
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.
4wxx DNA
(CYTOSINE-5)-METHYLT
RANSFERASE 1

(Homo sapiens) 		PF00145
(DNA_methylase)
PF01426
(BAH)
PF02008
(zf-CXXC)
PF12047
(DNMT1-RFD) 		3 LYS A1275
ARG A1269
VAL A1268
 None
 0.96A 4x3uA-4wxxA:
1.0
4x3uB-4wxxA:
0.8		 4x3uA-4wxxA:
4.85
4x3uB-4wxxA:
4.85
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.
4z7f FOLATE ECF
TRANSPORTER

(Enterococcus
faecalis) 		PF12822
(ECF_trnsprt) 		3 LYS A  36
ARG A  26
VAL A  22
 FOL  A 201 (-2.9A)
None
None
 0.90A 4x3uA-4z7fA:
undetectable
4x3uB-4z7fA:
undetectable		 4x3uA-4z7fA:
16.86
4x3uB-4z7fA:
16.86
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.
4zhj MG-CHELATASE SUBUNIT
CHLH

(Synechocystis
sp. PCC 6803) 		PF02514
(CobN-Mg_chel)
PF11965
(DUF3479) 		3 LYS A 502
ARG A1241
VAL A1240
 None
 1.05A 4x3uA-4zhjA:
undetectable
4x3uB-4zhjA:
undetectable		 4x3uA-4zhjA:
4.68
4x3uB-4zhjA:
4.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5apg TSR3

(Vulcanisaeta
distributa) 		PF04034
(Ribo_biogen_C) 		3 LYS A  50
ARG A 162
VAL A 167
 None
None
MES  A1186 (-4.1A)
 0.91A 4x3uA-5apgA:
undetectable
4x3uB-5apgA:
undetectable		 4x3uA-5apgA:
14.29
4x3uB-5apgA:
14.29
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.
5b5z PTLCIB4 H88A MUTANT

(Phaeodactylum
tricornutum) 		no annotation 3 LYS A   9
ARG A 246
VAL A 245
 None
 0.63A 4x3uA-5b5zA:
undetectable
4x3uB-5b5zA:
undetectable		 4x3uA-5b5zA:
11.03
4x3uB-5b5zA:
11.03
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.
5boe ENOLASE

(Staphylococcus
aureus) 		PF00113
(Enolase_C)
PF03952
(Enolase_N) 		3 LYS A 105
ARG A 372
VAL A 344
 None
PEP  A 501 (-3.7A)
None
 1.07A 4x3uA-5boeA:
undetectable
4x3uB-5boeA:
undetectable		 4x3uA-5boeA:
11.20
4x3uB-5boeA:
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.
5d7a TRAF2 AND
NCK-INTERACTING
PROTEIN KINASE

(Homo sapiens) 		PF00069
(Pkinase) 		3 LYS A 186
ARG A 152
VAL A 174
 ASN  A 186 ( 0.0A)
ARG  A 152 ( 0.6A)
VAL  A 174 ( 0.6A)
 0.88A 4x3uA-5d7aA:
undetectable
4x3uB-5d7aA:
undetectable		 4x3uA-5d7aA:
10.97
4x3uB-5d7aA:
10.97
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.
5drz HIV ANTIBODY F240
HEAVY CHAIN

(Homo sapiens) 		no annotation 3 LYS H  43
ARG H 108
VAL H 109
 None
 0.90A 4x3uA-5drzH:
undetectable
4x3uB-5drzH:
undetectable		 4x3uA-5drzH:
9.87
4x3uB-5drzH:
9.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5dxv RETHREADED DHFR

(synthetic
construct) 		PF00186
(DHFR_1) 		3 LYS A 141
ARG A  12
VAL A  10
 CME  A 140 ( 3.3A)
None
None
 0.88A 4x3uA-5dxvA:
undetectable
4x3uB-5dxvA:
undetectable		 4x3uA-5dxvA:
18.59
4x3uB-5dxvA:
18.59
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.
5e0n ENOYL-COA
HYDRATASE/ISOMERASE

(Mycolicibacterium
smegmatis) 		PF00378
(ECH_1) 		3 LYS X 221
ARG X  53
VAL X  52
 None
 1.05A 4x3uA-5e0nX:
undetectable
4x3uB-5e0nX:
undetectable		 4x3uA-5e0nX:
11.81
4x3uB-5e0nX:
11.81
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.
5fca ACID
SPHINGOMYELINASE-LIK
E PHOSPHODIESTERASE
3A

(Mus musculus) 		PF00149
(Metallophos) 		3 LYS A 402
ARG A 333
VAL A 348
 None
None
GOL  A 520 ( 4.5A)
 0.89A 4x3uA-5fcaA:
undetectable
4x3uB-5fcaA:
undetectable		 4x3uA-5fcaA:
10.73
4x3uB-5fcaA:
10.73
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.
5guf CDP-ARCHAEOL
SYNTHASE

(Aeropyrum
pernix) 		no annotation 3 LYS A  57
ARG A 109
VAL A 106
 CTP  A 201 (-2.4A)
None
None
 0.68A 4x3uA-5gufA:
undetectable
4x3uB-5gufA:
undetectable		 4x3uA-5gufA:
20.35
4x3uB-5gufA:
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.
5gw5 T-COMPLEX PROTEIN 1
SUBUNIT ETA
T-COMPLEX PROTEIN 1
SUBUNIT THETA

(Saccharomyces
cerevisiae) 		PF00118
(Cpn60_TCP1) 		3 LYS q 171
ARG q  51
VAL h 520
 None
 0.84A 4x3uA-5gw5q:
undetectable
4x3uB-5gw5q:
undetectable		 4x3uA-5gw5q:
7.93
4x3uB-5gw5q:
7.93
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.
5hzg F-BOX/LRR-REPEAT
MAX2 HOMOLOG

(Oryza sativa) 		no annotation 3 LYS B 585
ARG B  36
VAL B  35
 None
 0.98A 4x3uA-5hzgB:
undetectable
4x3uB-5hzgB:
undetectable		 4x3uA-5hzgB:
5.53
4x3uB-5hzgB:
5.53
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.
5hzh RAS-RELATED C3
BOTULINUM TOXIN
SUBSTRATE
1,NPH1-1,RAS-RELATED
C3 BOTULINUM TOXIN
SUBSTRATE 1

(Avena sativa;
Homo sapiens) 		PF00071
(Ras)
PF13426
(PAS_9) 		3 LYS A 191
ARG A  68
VAL A 153
 None
 0.91A 4x3uA-5hzhA:
undetectable
4x3uB-5hzhA:
undetectable		 4x3uA-5hzhA:
12.84
4x3uB-5hzhA:
12.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5hzk INTERSECTIN-1,NPH1-1
,INTERSECTIN-1

(Avena sativa;
Homo sapiens) 		PF00621
(RhoGEF)
PF13426
(PAS_9)
PF16652
(PH_13) 		3 LYS B1449
ARG B1326
VAL B1411
 None
 0.86A 4x3uA-5hzkB:
undetectable
4x3uB-5hzkB:
undetectable		 4x3uA-5hzkB:
8.97
4x3uB-5hzkB:
8.97
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.
5i2t PERIODIC TRYPTOPHAN
PROTEIN 2

(Saccharomyces
cerevisiae) 		PF00400
(WD40) 		3 LYS A 397
ARG A 359
VAL A 360
 None
 1.05A 4x3uA-5i2tA:
undetectable
4x3uB-5i2tA:
undetectable		 4x3uA-5i2tA:
6.72
4x3uB-5i2tA:
6.72
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.
5i6r SLIT-ROBO RHO
GTPASE-ACTIVATING
PROTEIN 2

(Homo sapiens) 		PF00611
(FCH) 		3 LYS A 143
ARG A  42
VAL A  43
 None
 0.93A 4x3uA-5i6rA:
undetectable
4x3uB-5i6rA:
undetectable		 4x3uA-5i6rA:
8.06
4x3uB-5i6rA:
8.06
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.
5ip9 DNA-DIRECTED RNA
POLYMERASE II
SUBUNIT RPB1

(Saccharomyces
cerevisiae) 		PF00623
(RNA_pol_Rpb1_2)
PF04983
(RNA_pol_Rpb1_3)
PF04990
(RNA_pol_Rpb1_7)
PF04992
(RNA_pol_Rpb1_6)
PF04997
(RNA_pol_Rpb1_1)
PF04998
(RNA_pol_Rpb1_5)
PF05000
(RNA_pol_Rpb1_4) 		3 LYS A 687
ARG A 726
VAL A 765
 None
 1.07A 4x3uA-5ip9A:
undetectable
4x3uB-5ip9A:
undetectable		 4x3uA-5ip9A:
4.64
4x3uB-5ip9A:
4.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ip9 DNA-DIRECTED RNA
POLYMERASE II
SUBUNIT RPB2

(Saccharomyces
cerevisiae) 		PF00562
(RNA_pol_Rpb2_6)
PF04560
(RNA_pol_Rpb2_7)
PF04561
(RNA_pol_Rpb2_2)
PF04563
(RNA_pol_Rpb2_1)
PF04565
(RNA_pol_Rpb2_3)
PF04566
(RNA_pol_Rpb2_4)
PF04567
(RNA_pol_Rpb2_5) 		3 LYS B 972
ARG B 904
VAL B 905
 None
 1.06A 4x3uA-5ip9B:
2.3
4x3uB-5ip9B:
undetectable		 4x3uA-5ip9B:
4.67
4x3uB-5ip9B:
4.67
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.
5ivx T-CELL RECEPTOR BETA
CHAIN

(Mus musculus) 		PF07654
(C1-set)
PF07686
(V-set) 		3 LYS F 128
ARG F 187
VAL F 188
 None
 0.75A 4x3uA-5ivxF:
undetectable
4x3uB-5ivxF:
undetectable		 4x3uA-5ivxF:
15.25
4x3uB-5ivxF:
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.
5j0n INTEGRASE

(Escherichia
virus Lambda) 		PF00589
(Phage_integrase)
PF02899
(Phage_int_SAM_1) 		3 LYS E 141
ARG E 176
VAL E 175
 None
 0.77A 4x3uA-5j0nE:
undetectable
4x3uB-5j0nE:
undetectable		 4x3uA-5j0nE:
13.75
4x3uB-5j0nE:
13.75
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.
5ju6 BETA-GLUCOSIDASE

(Rasamsonia
emersonii) 		PF00933
(Glyco_hydro_3)
PF01915
(Glyco_hydro_3_C)
PF14310
(Fn3-like) 		3 LYS A 675
ARG A 333
VAL A 332
 None
 1.00A 4x3uA-5ju6A:
undetectable
4x3uB-5ju6A:
undetectable		 4x3uA-5ju6A:
6.08
4x3uB-5ju6A:
6.08
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.
5ldn HEXON PROTEIN,HEXON
CAPSID

(Human
mastadenovirus
C) 		PF01065
(Adeno_hexon)
PF03678
(Adeno_hexon_C) 		3 LYS A 126
ARG A 836
VAL A 828
 None
 0.92A 4x3uA-5ldnA:
undetectable
4x3uB-5ldnA:
undetectable		 4x3uA-5ldnA:
5.18
4x3uB-5ldnA:
5.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5lrb ALPHA-1,4 GLUCAN
PHOSPHORYLASE

(Hordeum vulgare) 		PF00343
(Phosphorylase) 		3 LYS A 104
ARG A 240
VAL A 239
 None
 0.85A 4x3uA-5lrbA:
0.4
4x3uB-5lrbA:
undetectable		 4x3uA-5lrbA:
5.76
4x3uB-5lrbA:
5.76
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.
5o0x PUTATIVE FERRIC
REDUCTASE

(Cylindrospermum
stagnale) 		PF08022
(FAD_binding_8)
PF08030
(NAD_binding_6) 		3 LYS A 548
ARG A 434
VAL A 472
 PEG  A 816 (-2.5A)
CL  A 804 ( 4.1A)
None
 0.87A 4x3uA-5o0xA:
1.2
4x3uB-5o0xA:
1.5		 4x3uA-5o0xA:
12.03
4x3uB-5o0xA:
12.03
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.
5tpt AMYLOID-LIKE PROTEIN
2

(Homo sapiens) 		no annotation 3 LYS A 394
ARG A 459
VAL A 460
 None
 1.01A 4x3uA-5tptA:
undetectable
4x3uB-5tptA:
undetectable		 4x3uA-5tptA:
22.62
4x3uB-5tptA:
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.
5txf PHOSPHATIDYLCHOLINE-
STEROL
ACYLTRANSFERASE

(Homo sapiens) 		no annotation 3 LYS A 173
ARG A 140
VAL A 139
 None
 0.82A 4x3uA-5txfA:
undetectable
4x3uB-5txfA:
undetectable		 4x3uA-5txfA:
11.17
4x3uB-5txfA:
11.17
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5u30 CRISPR-ASSOCIATED
ENDONUCLEASE C2C1

(Alicyclobacillus
acidoterrestris) 		no annotation 3 LYS A 188
ARG A 192
VAL A 193
 None
SO4  A1202 (-3.8A)
None
 1.01A 4x3uA-5u30A:
undetectable
4x3uB-5u30A:
undetectable		 4x3uA-5u30A:
6.84
4x3uB-5u30A:
6.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5u8s DNA REPLICATION
LICENSING FACTOR
MCM4

(Saccharomyces
cerevisiae) 		PF00493
(MCM)
PF14551
(MCM_N)
PF17207
(MCM_OB) 		3 LYS 4 874
ARG 4 925
VAL 4 927
 None
 1.00A 4x3uA-5u8s4:
undetectable
4x3uB-5u8s4:
undetectable		 4x3uA-5u8s4:
4.82
4x3uB-5u8s4:
4.82
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.
5vni PROTEIN TRANSPORT
PROTEIN SEC24A

(Homo sapiens) 		PF00626
(Gelsolin)
PF04810
(zf-Sec23_Sec24)
PF04811
(Sec23_trunk)
PF04815
(Sec23_helical)
PF08033
(Sec23_BS) 		3 LYS B 674
ARG B 769
VAL B 768
 None
 0.94A 4x3uA-5vniB:
undetectable
4x3uB-5vniB:
undetectable		 4x3uA-5vniB:
6.75
4x3uB-5vniB:
6.75
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5wm4 SALICYLATE-AMP
LIGASE

(Streptomyces
gandocaensis) 		no annotation 3 LYS A 545
ARG A 528
VAL A 529
 None
 0.94A 4x3uA-5wm4A:
undetectable
4x3uB-5wm4A:
undetectable		 4x3uA-5wm4A:
30.43
4x3uB-5wm4A:
30.43
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.
5xbp 3NT OXYGENASE ALPHA
SUBUNIT
3NT OXYGENASE BETA
SUBUNIT

(Diaphorobacter
sp. DS2) 		PF00355
(Rieske)
PF00848
(Ring_hydroxyl_A)
PF00866
(Ring_hydroxyl_B) 		3 LYS A 190
ARG C 144
VAL C 151
 None
 0.74A 4x3uA-5xbpA:
undetectable
4x3uB-5xbpA:
undetectable		 4x3uA-5xbpA:
10.02
4x3uB-5xbpA:
10.02
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.
5xtd NADH DEHYDROGENASE
[UBIQUINONE] 1 ALPHA
SUBCOMPLEX SUBUNIT
10, MITOCHONDRIAL

(Homo sapiens) 		PF06212
(GRIM-19) 		3 LYS w 252
ARG w  58
VAL w  59
 None
 0.90A 4x3uA-5xtdw:
undetectable
4x3uB-5xtdw:
undetectable		 4x3uA-5xtdw:
12.21
4x3uB-5xtdw:
12.21
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.
5y3r DNA-DEPENDENT
PROTEIN KINASE
CATALYTIC SUBUNIT
X-RAY REPAIR
CROSS-COMPLEMENTING
PROTEIN 6

(Homo sapiens) 		PF00454
(PI3_PI4_kinase)
PF02259
(FAT)
PF02260
(FATC)
PF02735
(Ku)
PF03730
(Ku_C)
PF03731
(Ku_N)
PF08163
(NUC194) 		3 LYS A 338
ARG C 213
VAL C 212
 None
 0.72A 4x3uA-5y3rA:
undetectable
4x3uB-5y3rA:
undetectable		 4x3uA-5y3rA:
8.08
4x3uB-5y3rA:
8.08
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.
5y79 PUTATIVE HEXOSE
PHOSPHATE
TRANSLOCATOR

(Galdieria
sulphuraria) 		PF03151
(TPT) 		3 LYS A 128
ARG A 363
VAL A 202
 None
3PG  A 516 (-2.9A)
OLC  A 505 (-4.9A)
 0.89A 4x3uA-5y79A:
undetectable
4x3uB-5y79A:
undetectable		 4x3uA-5y79A:
8.81
4x3uB-5y79A:
8.81
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.
5yge AMINO-ACID
ACETYLTRANSFERASE

(Mycobacterium
tuberculosis) 		no annotation 3 LYS A 161
ARG A 111
VAL A 112
 None
 0.88A 4x3uA-5ygeA:
undetectable
4x3uB-5ygeA:
undetectable		 4x3uA-5ygeA:
19.01
4x3uB-5ygeA:
19.01
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.
6cv0 SPIKE GLYCOPROTEIN

(Avian
coronavirus) 		no annotation 3 LYS A 901
ARG A 778
VAL A 922
 None
 1.01A 4x3uA-6cv0A:
undetectable
4x3uB-6cv0A:
undetectable		 4x3uA-6cv0A:
18.75
4x3uB-6cv0A:
18.75
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.
6emk SERINE/THREONINE-PRO
TEIN KINASE TOR2

(Saccharomyces
cerevisiae) 		no annotation 3 LYS A1533
ARG A1545
VAL A1542
 None
 1.06A 4x3uA-6emkA:
undetectable
4x3uB-6emkA:
undetectable		 4x3uA-6emkA:
17.50
4x3uB-6emkA:
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.
6emk SERINE/THREONINE-PRO
TEIN KINASE TOR2

(Saccharomyces
cerevisiae) 		no annotation 3 LYS A2430
ARG A2347
VAL A2345
 None
 1.08A 4x3uA-6emkA:
undetectable
4x3uB-6emkA:
undetectable		 4x3uA-6emkA:
17.50
4x3uB-6emkA:
17.50