SIMILAR PATTERNS OF AMINO ACIDS FOR 5CDN_N_EVPN2101_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.
1io1 PHASE 1 FLAGELLIN

(Salmonella
enterica) 		PF00669
(Flagellin_N)
PF00700
(Flagellin_C)
PF08884
(Flagellin_D3) 		4 GLU A 290
GLY A 328
ASP A 330
GLY A 302
 None
 0.92A 5cdnR-1io1A:
2.4
5cdnS-1io1A:
undetectable		 5cdnR-1io1A:
21.50
5cdnS-1io1A:
19.69
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.
1jcf ROD
SHAPE-DETERMINING
PROTEIN MREB

(Thermotoga
maritima) 		PF06723
(MreB_Mbl) 		5 SER A 174
GLU A 173
GLY A  11
ASP A   9
GLY A 156
 None
 1.33A 5cdnR-1jcfA:
0.0
5cdnS-1jcfA:
2.0		 5cdnR-1jcfA:
22.95
5cdnS-1jcfA:
20.68
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.
1mor GLUCOSAMINE
6-PHOSPHATE SYNTHASE

(Escherichia
coli) 		PF01380
(SIS) 		4 GLU A 563
GLY A 473
ARG A 472
GLY A 471
 None
 0.77A 5cdnR-1morA:
0.0
5cdnS-1morA:
3.5		 5cdnR-1morA:
23.46
5cdnS-1morA:
19.24
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.
1n0w DNA REPAIR PROTEIN
RAD51 HOMOLOG 1

(Homo sapiens) 		PF08423
(Rad51) 		4 GLU A 154
GLY A 333
ASP A 332
GLY A 105
 EDO  A 502 (-2.9A)
None
None
None
 0.85A 5cdnR-1n0wA:
undetectable
5cdnS-1n0wA:
undetectable		 5cdnR-1n0wA:
19.63
5cdnS-1n0wA:
21.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1pmr DIHYDROLIPOYL
SUCCINYLTRANSFERASE

(Escherichia
coli) 		PF00364
(Biotin_lipoyl) 		4 GLY A  54
ASP A  53
ARG A  77
GLY A  27
 None
 0.93A 5cdnR-1pmrA:
undetectable
5cdnS-1pmrA:
undetectable		 5cdnR-1pmrA:
10.55
5cdnS-1pmrA:
18.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1qon ACETYLCHOLINESTERASE

(Drosophila
melanogaster) 		PF00135
(COesterase) 		4 SER A  90
GLU A  91
GLY A  61
GLY A  31
 None
None
BMA  A 996 (-2.6A)
None
 0.78A 5cdnR-1qonA:
undetectable
5cdnS-1qonA:
undetectable		 5cdnR-1qonA:
22.73
5cdnS-1qonA:
14.76
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.
1sfe ADA
O6-METHYLGUANINE-DNA
METHYLTRANSFERASE

(Escherichia
coli) 		PF01035
(DNA_binding_1)
PF02870
(Methyltransf_1N) 		4 GLY A  24
ASP A  20
ARG A  25
GLY A  41
 None
 0.91A 5cdnR-1sfeA:
0.1
5cdnS-1sfeA:
undetectable		 5cdnR-1sfeA:
18.71
5cdnS-1sfeA:
21.18
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.
1te5 CONSERVED
HYPOTHETICAL PROTEIN

(Pseudomonas
aeruginosa) 		PF13230
(GATase_4) 		4 SER A  72
GLU A  73
GLY A  38
GLY A  77
 None
 0.85A 5cdnR-1te5A:
undetectable
5cdnS-1te5A:
undetectable		 5cdnR-1te5A:
19.57
5cdnS-1te5A:
24.05
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.
1u2v ACTIN-RELATED
PROTEIN 3

(Bos taurus) 		PF00022
(Actin) 		4 SER A 170
ASP A 338
ARG A 334
GLY A 332
 None
 0.90A 5cdnR-1u2vA:
0.0
5cdnS-1u2vA:
3.0		 5cdnR-1u2vA:
22.02
5cdnS-1u2vA:
18.05
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.
1u6r CREATINE KINASE, M
CHAIN

(Oryctolagus
cuniculus) 		PF00217
(ATP-gua_Ptrans)
PF02807
(ATP-gua_PtransN) 		4 GLU A 274
GLY A 133
ASP A 232
GLY A 289
 None
 0.90A 5cdnR-1u6rA:
undetectable
5cdnS-1u6rA:
undetectable		 5cdnR-1u6rA:
22.73
5cdnS-1u6rA:
20.70
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1v26 LONG-CHAIN-FATTY-ACI
D-COA SYNTHETASE

(Thermus
thermophilus) 		PF00501
(AMP-binding)
PF13193
(AMP-binding_C) 		4 GLU A  87
GLY A  72
ASP A  73
GLY A  96
 None
 0.89A 5cdnR-1v26A:
undetectable
5cdnS-1v26A:
undetectable		 5cdnR-1v26A:
24.27
5cdnS-1v26A:
15.87
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.
1vpe PHOSPHOGLYCERATE
KINASE

(Thermotoga
maritima) 		PF00162
(PGK) 		4 GLU A 366
GLY A 147
ASP A  21
GLY A 376
 None
3PG  A 401 (-4.7A)
3PG  A 401 (-2.9A)
ANP  A 400 (-3.5A)
 0.77A 5cdnR-1vpeA:
undetectable
5cdnS-1vpeA:
undetectable		 5cdnR-1vpeA:
23.51
5cdnS-1vpeA:
19.08
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.
1w78 FOLC BIFUNCTIONAL
PROTEIN

(Escherichia
coli) 		PF02875
(Mur_ligase_C)
PF08245
(Mur_ligase_M) 		4 SER A  36
GLY A 190
ARG A 152
GLY A 151
 None
KCX  A 188 ( 4.1A)
None
KCX  A 188 ( 4.1A)
 0.90A 5cdnR-1w78A:
undetectable
5cdnS-1w78A:
undetectable		 5cdnR-1w78A:
23.83
5cdnS-1w78A:
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.
1wju NEDD8 ULTIMATE
BUSTER-1

(Homo sapiens) 		no annotation 4 GLU A  90
GLY A  72
ARG A  43
GLY A  42
 None
 0.83A 5cdnR-1wjuA:
undetectable
5cdnS-1wjuA:
undetectable		 5cdnR-1wjuA:
13.12
5cdnS-1wjuA:
20.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1x1q TRYPTOPHAN SYNTHASE
BETA CHAIN

(Thermus
thermophilus) 		PF00291
(PALP) 		4 GLY A 403
ASP A 404
ARG A 402
GLY A 401
 None
 0.74A 5cdnR-1x1qA:
undetectable
5cdnS-1x1qA:
undetectable		 5cdnR-1x1qA:
23.80
5cdnS-1x1qA:
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.
1z45 GAL10 BIFUNCTIONAL
PROTEIN

(Saccharomyces
cerevisiae) 		PF01263
(Aldose_epim)
PF16363
(GDP_Man_Dehyd) 		4 GLU A 485
GLY A 462
ARG A 429
GLY A 428
 None
 0.91A 5cdnR-1z45A:
undetectable
5cdnS-1z45A:
2.7		 5cdnR-1z45A:
22.07
5cdnS-1z45A:
15.88
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.
2aqx PREDICTED: INOSITOL
1,4,5-TRISPHOSPHATE
3-KINASE B

(Mus musculus) 		PF03770
(IPK) 		4 SER A 800
GLY A 920
ASP A 919
GLY A 924
 None
 0.90A 5cdnR-2aqxA:
1.6
5cdnS-2aqxA:
undetectable		 5cdnR-2aqxA:
21.38
5cdnS-2aqxA:
22.18
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.
2e5v L-ASPARTATE OXIDASE

(Sulfurisphaera
tokodaii) 		PF00890
(FAD_binding_2)
PF02910
(Succ_DH_flav_C) 		4 SER A  29
GLU A 138
GLY A 361
GLY A  15
 FAD  A1002 (-2.9A)
None
None
None
 0.91A 5cdnR-2e5vA:
undetectable
5cdnS-2e5vA:
undetectable		 5cdnR-2e5vA:
22.84
5cdnS-2e5vA:
17.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2es3 THROMBOSPONDIN-1

(Homo sapiens) 		PF02210
(Laminin_G_2) 		4 GLY A  84
ASP A 188
ARG A  83
GLY A 105
 None
 0.89A 5cdnR-2es3A:
undetectable
5cdnS-2es3A:
undetectable		 5cdnR-2es3A:
19.38
5cdnS-2es3A:
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.
2gbs HYPOTHETICAL PROTEIN
RPA0253

(Rhodopseudomonas
palustris) 		PF01878
(EVE) 		4 SER A   8
GLU A   9
GLY A  25
ASP A  85
 None
 0.79A 5cdnR-2gbsA:
undetectable
5cdnS-2gbsA:
undetectable		 5cdnR-2gbsA:
14.78
5cdnS-2gbsA:
20.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2hk0 D-PSICOSE
3-EPIMERASE

(Agrobacterium
tumefaciens) 		PF01261
(AP_endonuc_2) 		4 SER A   8
GLU A  11
GLY A 106
GLY A  67
 SER  A   8 ( 0.0A)
GLU  A  11 ( 0.6A)
GLY  A 106 ( 0.0A)
GLY  A  67 ( 0.0A)
 0.81A 5cdnR-2hk0A:
undetectable
5cdnS-2hk0A:
undetectable		 5cdnR-2hk0A:
23.31
5cdnS-2hk0A:
21.41
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.
2i7x PROTEIN CFT2

(Saccharomyces
cerevisiae) 		PF16661
(Lactamase_B_6) 		4 SER A 343
GLU A 344
GLY A 112
GLY A 109
 None
 0.90A 5cdnR-2i7xA:
undetectable
5cdnS-2i7xA:
undetectable		 5cdnR-2i7xA:
21.20
5cdnS-2i7xA:
13.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2inv INSULIN
FRUCTOTRANSFERASE

(Bacillus sp.
snu-7) 		no annotation 4 SER A 133
GLY A 271
ASP A 270
GLY A 293
 FRU  A   1 (-2.7A)
None
None
None
 0.89A 5cdnR-2invA:
undetectable
5cdnS-2invA:
undetectable		 5cdnR-2invA:
22.49
5cdnS-2invA:
19.20
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.
2jbh PHOSPHORIBOSYLTRANSF
ERASE
DOMAIN-CONTAINING
PROTEIN 1

(Homo sapiens) 		PF00156
(Pribosyltran) 		4 SER A 155
GLY A 180
ASP A 179
GLY A 147
 None
None
None
5GP  A1230 (-3.5A)
 0.91A 5cdnR-2jbhA:
undetectable
5cdnS-2jbhA:
2.7		 5cdnR-2jbhA:
19.27
5cdnS-2jbhA:
19.40
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.
2ker ALPHA-AMYLASE
INHIBITOR Z-2685

(Streptomyces
parvulus) 		PF01356
(A_amylase_inhib) 		4 GLY A  61
ASP A  60
ARG A  17
GLY A  56
 None
 0.92A 5cdnR-2kerA:
undetectable
5cdnS-2kerA:
undetectable		 5cdnR-2kerA:
7.96
5cdnS-2kerA:
17.71
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.
2pod MANDELATE RACEMASE /
MUCONATE LACTONIZING
ENZYME

(Burkholderia
pseudomallei) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		4 SER A 301
GLU A 302
GLY A  30
GLY A  32
 None
 0.92A 5cdnR-2podA:
undetectable
5cdnS-2podA:
undetectable		 5cdnR-2podA:
21.69
5cdnS-2podA:
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.
2qua EXTRACELLULAR LIPASE

(Serratia
marcescens) 		no annotation 4 SER A 231
GLU A 199
GLY A 181
GLY A 185
 None
 0.71A 5cdnR-2quaA:
undetectable
5cdnS-2quaA:
undetectable		 5cdnR-2quaA:
22.20
5cdnS-2quaA:
16.94
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.
2spt PROTHROMBIN

(Bos taurus) 		PF00051
(Kringle)
PF00594
(Gla) 		4 GLU A 138
GLY A  64
ARG A  75
GLY A  76
 None
 0.88A 5cdnR-2sptA:
undetectable
5cdnS-2sptA:
undetectable		 5cdnR-2sptA:
14.62
5cdnS-2sptA:
21.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2vsx EUKARYOTIC
INITIATION FACTOR 4F
SUBUNIT P150

(Saccharomyces
cerevisiae) 		PF02854
(MIF4G) 		4 SER E 780
GLU E 781
GLY E 710
GLY E 743
 None
 0.91A 5cdnR-2vsxE:
undetectable
5cdnS-2vsxE:
undetectable		 5cdnR-2vsxE:
21.35
5cdnS-2vsxE:
19.59
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.
2vvq RIBOSE-5-PHOSPHATE
ISOMERASE B

(Mycobacterium
tuberculosis) 		PF02502
(LacAB_rpiB) 		4 GLU A  23
GLY A  69
ASP A  11
GLY A 112
 None
R10  A 200 (-3.5A)
R10  A 200 (-2.8A)
None
 0.93A 5cdnR-2vvqA:
undetectable
5cdnS-2vvqA:
2.2		 5cdnR-2vvqA:
15.34
5cdnS-2vvqA:
18.41
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.
2xkk TOPOISOMERASE IV

(Acinetobacter
baumannii) 		PF00521
(DNA_topoisoIV)
PF00986
(DNA_gyraseB_C)
PF01751
(Toprim) 		4 GLY A 396
ASP A 397
ARG A 418
GLY A 419
 None
 0.80A 5cdnR-2xkkA:
48.7
5cdnS-2xkkA:
23.0		 5cdnR-2xkkA:
29.33
5cdnS-2xkkA:
21.74
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2yd0 ENDOPLASMIC
RETICULUM
AMINOPEPTIDASE 1

(Homo sapiens) 		PF01433
(Peptidase_M1)
PF11838
(ERAP1_C) 		4 SER A 821
GLU A 820
GLY A 877
GLY A 840
 None
 0.67A 5cdnR-2yd0A:
2.0
5cdnS-2yd0A:
undetectable		 5cdnR-2yd0A:
19.04
5cdnS-2yd0A:
11.50
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.
3b5q PUTATIVE SULFATASE
YIDJ

(Bacteroides
thetaiotaomicron) 		PF00884
(Sulfatase)
PF16347
(DUF4976) 		4 SER A 373
GLU A 374
GLY A 287
ASP A 286
 None
 0.65A 5cdnR-3b5qA:
undetectable
5cdnS-3b5qA:
undetectable		 5cdnR-3b5qA:
22.46
5cdnS-3b5qA:
16.84
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.
3e79 HIGH AFFINITY
TRANSPORT SYSTEM
PROTEIN P37

(Mycoplasma
hyorhinis) 		PF06646
(Mycoplasma_p37) 		4 SER A 127
ASP A 155
ARG A 216
GLY A 217
 None
 0.91A 5cdnR-3e79A:
undetectable
5cdnS-3e79A:
undetectable		 5cdnR-3e79A:
21.77
5cdnS-3e79A:
19.80
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.
3god CAS1

(Pseudomonas
aeruginosa) 		PF01867
(Cas_Cas1) 		4 GLU A 189
GLY A 261
ARG A 258
GLY A 255
 None
 0.76A 5cdnR-3godA:
undetectable
5cdnS-3godA:
undetectable		 5cdnR-3godA:
21.77
5cdnS-3godA:
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.
3gx1 LIN1832 PROTEIN

(Listeria
innocua) 		PF03610
(EIIA-man) 		4 SER A 570
GLY A 649
ASP A 652
ARG A 648
 SO4  A 708 (-3.1A)
SO4  A 704 ( 3.9A)
None
SO4  A 702 ( 2.7A)
 0.94A 5cdnR-3gx1A:
undetectable
5cdnS-3gx1A:
3.7		 5cdnR-3gx1A:
15.15
5cdnS-3gx1A:
21.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3h0g DNA-DIRECTED RNA
POLYMERASE II
SUBUNIT RPB1

(Schizosaccharomyces
pombe) 		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) 		4 SER A 221
GLY A 171
ASP A 118
GLY A 174
 None
 0.90A 5cdnR-3h0gA:
3.2
5cdnS-3h0gA:
undetectable		 5cdnR-3h0gA:
16.65
5cdnS-3h0gA:
9.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3h84 ATPASE GET3

(Saccharomyces
cerevisiae) 		PF02374
(ArsA_ATPase) 		4 SER A  55
GLY A 323
ARG A 322
GLY A  67
 None
 0.83A 5cdnR-3h84A:
undetectable
5cdnS-3h84A:
undetectable		 5cdnR-3h84A:
22.42
5cdnS-3h84A:
21.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3h8l NADH OXIDASE

(Acidianus
ambivalens) 		PF07992
(Pyr_redox_2) 		4 GLU A  75
GLY A 306
ASP A 307
GLY A  12
 PO4  A2001 (-2.5A)
FAD  A1001 (-3.2A)
FAD  A1001 (-3.2A)
FAD  A1001 (-3.8A)
 0.77A 5cdnR-3h8lA:
undetectable
5cdnS-3h8lA:
undetectable		 5cdnR-3h8lA:
21.57
5cdnS-3h8lA:
18.16
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.
3ldh LACTATE
DEHYDROGENASE

(Squalus
acanthias) 		PF00056
(Ldh_1_N)
PF02866
(Ldh_1_C) 		4 SER A  88
GLY A  33
ASP A  36
GLY A  28
 None
None
None
NAD  A 332 (-1.8A)
 0.94A 5cdnR-3ldhA:
undetectable
5cdnS-3ldhA:
undetectable		 5cdnR-3ldhA:
20.40
5cdnS-3ldhA:
19.22
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.
3n11 CHITINASE A

(Bacillus cereus) 		PF00704
(Glyco_hydro_18) 		4 SER A 146
GLU A 145
GLY A  71
ASP A  72
 None
 0.94A 5cdnR-3n11A:
undetectable
5cdnS-3n11A:
undetectable		 5cdnR-3n11A:
20.56
5cdnS-3n11A:
21.02
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.
3p4s FUMARATE REDUCTASE
FLAVOPROTEIN SUBUNIT

(Escherichia
coli) 		PF00890
(FAD_binding_2)
PF02910
(Succ_DH_flav_C) 		4 SER A 382
GLY A 530
ASP A  74
ARG A 529
 None
 0.91A 5cdnR-3p4sA:
2.0
5cdnS-3p4sA:
undetectable		 5cdnR-3p4sA:
23.77
5cdnS-3p4sA:
16.27
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.
3pqs TRANSFERRIN-BINDING
PROTEIN

(Actinobacillus
pleuropneumoniae) 		PF01298
(TbpB_B_D)
PF17483
(TbpB_C)
PF17484
(TbpB_A) 		4 SER A 425
GLU A 426
GLY A 381
ASP A 297
 None
None
None
GOL  A 529 (-3.0A)
 0.94A 5cdnR-3pqsA:
undetectable
5cdnS-3pqsA:
undetectable		 5cdnR-3pqsA:
22.30
5cdnS-3pqsA:
18.62
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.
3ptw MALONYL COA-ACYL
CARRIER PROTEIN
TRANSACYLASE

(Clostridium
perfringens) 		PF00698
(Acyl_transf_1) 		4 SER A  37
GLU A  38
GLY A  17
GLY A  19
 None
 0.77A 5cdnR-3ptwA:
undetectable
5cdnS-3ptwA:
undetectable		 5cdnR-3ptwA:
22.25
5cdnS-3ptwA:
22.19
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.
3r7p RIBOSOMAL PROTEIN
3/HOMING
ENDONUCLEASE-LIKE
FUSION PROTEIN

(Leptographium
truncatum) 		PF00961
(LAGLIDADG_1) 		4 SER A  66
GLU A  69
GLY A 183
GLY A 179
 None
None
MN  A 316 ( 4.6A)
None
 0.92A 5cdnR-3r7pA:
2.2
5cdnS-3r7pA:
undetectable		 5cdnR-3r7pA:
22.02
5cdnS-3r7pA:
21.34
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.
3r9p ACKA

(Mycobacterium
avium) 		PF00871
(Acetate_kinase) 		4 SER A 216
GLU A 223
GLY A 321
GLY A 199
 None
None
None
PGE  A 390 ( 4.4A)
 0.90A 5cdnR-3r9pA:
undetectable
5cdnS-3r9pA:
undetectable		 5cdnR-3r9pA:
23.90
5cdnS-3r9pA:
19.08
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.
3stb MP18 RNA EDITING
COMPLEX PROTEIN

(Trypanosoma
brucei) 		PF00436
(SSB) 		4 GLU D  77
GLY D  97
ARG D  98
GLY D 125
 None
 0.89A 5cdnR-3stbD:
undetectable
5cdnS-3stbD:
undetectable		 5cdnR-3stbD:
13.36
5cdnS-3stbD:
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.
3tc8 LEUCINE
AMINOPEPTIDASE

(Parabacteroides
distasonis) 		PF04389
(Peptidase_M28) 		4 GLU A 313
GLY A 148
ASP A 147
GLY A 151
 None
None
ZN  A 350 ( 2.3A)
None
 0.81A 5cdnR-3tc8A:
undetectable
5cdnS-3tc8A:
2.6		 5cdnR-3tc8A:
20.83
5cdnS-3tc8A:
20.13
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.
3us8 ISOCITRATE
DEHYDROGENASE [NADP]

(Sinorhizobium
meliloti) 		PF00180
(Iso_dh) 		4 SER A 186
GLU A 185
GLY A 272
GLY A 131
 None
 0.85A 5cdnR-3us8A:
undetectable
5cdnS-3us8A:
2.9		 5cdnR-3us8A:
21.54
5cdnS-3us8A:
19.15
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.
3vtf UDP-GLUCOSE
6-DEHYDROGENASE

(Pyrobaculum
islandicum) 		PF00984
(UDPG_MGDP_dh)
PF03720
(UDPG_MGDP_dh_C)
PF03721
(UDPG_MGDP_dh_N) 		4 SER A 367
GLY A 320
ASP A 353
GLY A 335
 None
 0.81A 5cdnR-3vtfA:
undetectable
5cdnS-3vtfA:
undetectable		 5cdnR-3vtfA:
22.67
5cdnS-3vtfA:
17.00
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.
3x1b LACCASE

(Lentinus) 		PF00394
(Cu-oxidase)
PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3) 		4 SER A 115
GLY A  59
ASP A  63
GLY A  24
 None
 0.82A 5cdnR-3x1bA:
undetectable
5cdnS-3x1bA:
undetectable		 5cdnR-3x1bA:
23.60
5cdnS-3x1bA:
15.53
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.
4a0k DNA DAMAGE-BINDING
PROTEIN 2

(Danio rerio) 		PF00400
(WD40) 		4 GLU D 324
GLY D 391
ASP D 407
ARG D 392
 None
 0.92A 5cdnR-4a0kD:
undetectable
5cdnS-4a0kD:
undetectable		 5cdnR-4a0kD:
19.59
5cdnS-4a0kD:
17.75
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.
4acz ENDO-ALPHA-MANNOSIDA
SE

(Bacteroides
thetaiotaomicron) 		PF16317
(Glyco_hydro_99) 		4 SER B 121
GLY B 244
ASP B 243
GLY B 226
 None
 0.75A 5cdnR-4aczB:
undetectable
5cdnS-4aczB:
undetectable		 5cdnR-4aczB:
21.83
5cdnS-4aczB:
20.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4dnh UNCHARACTERIZED
PROTEIN

(Sinorhizobium
meliloti) 		PF06187
(DUF993) 		4 SER A 233
GLY A  89
ASP A 123
ARG A  88
 GOL  A 500 (-2.6A)
None
None
None
 0.82A 5cdnR-4dnhA:
undetectable
5cdnS-4dnhA:
undetectable		 5cdnR-4dnhA:
23.20
5cdnS-4dnhA:
18.62
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.
4dok SIMILARITY TO
CHALCONE-FLAVONONE
ISOMERASE

(Arabidopsis
thaliana) 		PF02431
(Chalcone) 		4 SER A  81
GLY A 191
ARG A 190
GLY A 188
 None
 0.83A 5cdnR-4dokA:
undetectable
5cdnS-4dokA:
undetectable		 5cdnR-4dokA:
18.92
5cdnS-4dokA:
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.
4f98 HYPOTHETICAL PROTEIN

(Pseudomonas
aeruginosa) 		PF10976
(DUF2790) 		4 GLY A  28
ASP A  26
ARG A  29
GLY A  30
 None
 0.78A 5cdnR-4f98A:
undetectable
5cdnS-4f98A:
undetectable		 5cdnR-4f98A:
9.35
5cdnS-4f98A:
16.11
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.
4hpn PUTATIVE
UNCHARACTERIZED
PROTEIN

(Agrobacterium
fabrum) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		4 SER A 277
GLU A 278
GLY A  44
GLY A  46
 None
 0.94A 5cdnR-4hpnA:
undetectable
5cdnS-4hpnA:
undetectable		 5cdnR-4hpnA:
22.76
5cdnS-4hpnA:
19.90
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.
4hqf THROMBOSPONDIN-RELAT
ED ANONYMOUS
PROTEIN, TRAP

(Plasmodium
falciparum) 		PF00092
(VWA) 		4 SER A 171
GLU A 174
GLY A  57
GLY A  55
 CL  A 401 ( 3.9A)
None
None
None
 0.68A 5cdnR-4hqfA:
undetectable
5cdnS-4hqfA:
2.2		 5cdnR-4hqfA:
19.21
5cdnS-4hqfA:
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.
4j34 KYNURENINE
3-MONOOXYGENASE

(Saccharomyces
cerevisiae) 		PF01494
(FAD_binding_3) 		4 SER A 123
GLY A   9
ASP A  32
GLY A  14
 None
FAD  A 401 (-3.2A)
FAD  A 401 (-2.8A)
None
 0.88A 5cdnR-4j34A:
undetectable
5cdnS-4j34A:
undetectable		 5cdnR-4j34A:
20.43
5cdnS-4j34A:
18.05
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.
4j6o METALLOPHOSPHOESTERA
SE

(Ruminiclostridium
thermocellum) 		PF00149
(Metallophos) 		4 GLU A 340
GLY A 186
ASP A 392
GLY A 232
 None
None
MN  A 508 ( 4.7A)
None
 0.88A 5cdnR-4j6oA:
undetectable
5cdnS-4j6oA:
undetectable		 5cdnR-4j6oA:
19.63
5cdnS-4j6oA:
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.
4jlv C-TERMINAL FRAGMENT
OF MEMBRANE PROTEIN
CAPA1, PUTATIVE
UNCHARACTERIZED
PROTEIN CAPB1

(Staphylococcus
aureus) 		PF13614
(AAA_31) 		4 SER A1203
GLU A1199
GLY A1078
ASP A1157
 None
None
None
MG  A1302 ( 4.7A)
 0.90A 5cdnR-4jlvA:
undetectable
5cdnS-4jlvA:
undetectable		 5cdnR-4jlvA:
19.50
5cdnS-4jlvA:
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.
4jn7 ENOLASE

(Agrobacterium
tumefaciens) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		4 SER A 273
GLU A 274
GLY A  31
GLY A  33
 None
 0.73A 5cdnR-4jn7A:
undetectable
5cdnS-4jn7A:
undetectable		 5cdnR-4jn7A:
21.15
5cdnS-4jn7A:
18.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4mco TRAP DICARBOXYLATE
TRANSPORTER-DCTP
SUBUNIT

(Rhodoferax
ferrireducens) 		PF03480
(DctP) 		4 GLU A 226
GLY A 234
ASP A 283
GLY A 155
 None
 0.55A 5cdnR-4mcoA:
undetectable
5cdnS-4mcoA:
undetectable		 5cdnR-4mcoA:
20.73
5cdnS-4mcoA:
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.
4mx6 TRAP-TYPE
C4-DICARBOXYLATE:H+
SYMPORT SYSTEM
SUBSTRATE-BINDING
COMPONENT DCTP

(Shewanella
oneidensis) 		PF03480
(DctP) 		4 SER A 239
GLU A 238
ARG A 179
GLY A 216
 None
None
SIN  A 401 (-2.9A)
None
 0.91A 5cdnR-4mx6A:
undetectable
5cdnS-4mx6A:
undetectable		 5cdnR-4mx6A:
21.70
5cdnS-4mx6A:
21.41
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.
4nnb OBCA, OXALATE
BIOSYNTHETIC
COMPONENT A

(Burkholderia
glumae) 		PF05853
(BKACE) 		4 GLU A 473
GLY A  51
ASP A  50
GLY A 192
 MG  A 601 ( 2.6A)
None
None
None
 0.92A 5cdnR-4nnbA:
undetectable
5cdnS-4nnbA:
undetectable		 5cdnR-4nnbA:
23.65
5cdnS-4nnbA:
15.31
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.
4nzj PUTATIVE
ALPHA-GALACTOSIDASE

(Bacteroides
fragilis) 		PF05345
(He_PIG)
PF10632
(He_PIG_assoc)
PF16499
(Melibiase_2) 		4 GLY A  92
ASP A  93
ARG A 114
GLY A 116
 None
 0.87A 5cdnR-4nzjA:
undetectable
5cdnS-4nzjA:
undetectable		 5cdnR-4nzjA:
20.08
5cdnS-4nzjA:
17.68
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.
4o94 TRAP DICARBOXYLATE
TRANSPORTER DCTP
SUBUNIT

(Rhodopseudomonas
palustris) 		PF03480
(DctP) 		4 SER A 229
GLU A 228
ARG A 169
GLY A 206
 None
None
SIN  A 403 (-3.0A)
None
 0.82A 5cdnR-4o94A:
undetectable
5cdnS-4o94A:
undetectable		 5cdnR-4o94A:
20.33
5cdnS-4o94A:
19.34
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.
4ovr TRAP DICARBOXYLATE
TRANSPORTER, DCTP
SUBUNIT

(Xanthobacter
autotrophicus) 		PF03480
(DctP) 		4 SER A 228
GLU A 229
ARG A 168
GLY A 205
 None
None
GTR  A 403 (-2.9A)
None
 0.94A 5cdnR-4ovrA:
undetectable
5cdnS-4ovrA:
undetectable		 5cdnR-4ovrA:
20.45
5cdnS-4ovrA:
22.29
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4plb CHIMERA PROTEIN OF
DNA GYRASE SUBUNITS
B AND A

(Staphylococcus
aureus) 		PF00521
(DNA_topoisoIV)
PF00986
(DNA_gyraseB_C)
PF01751
(Toprim) 		4 SER B1084
GLY B 436
ARG B 458
GLY B 459
 None
 0.68A 5cdnR-4plbB:
56.5
5cdnS-4plbB:
30.7		 5cdnR-4plbB:
99.79
5cdnS-4plbB:
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.
4u1r ATP-DEPENDENT
6-PHOSPHOFRUCTOKINAS
E, PLATELET TYPE

(Homo sapiens) 		PF00365
(PFK) 		4 SER A 285
GLU A 286
GLY A 222
GLY A 218
 None
 0.91A 5cdnR-4u1rA:
undetectable
5cdnS-4u1rA:
3.1		 5cdnR-4u1rA:
20.52
5cdnS-4u1rA:
14.51
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.
4u7l LEUCINE-RICH REPEATS
AND
IMMUNOGLOBULIN-LIKE
DOMAINS PROTEIN 1

(Homo sapiens) 		PF01463
(LRRCT)
PF13855
(LRR_8) 		4 GLU A 271
GLY A 340
ASP A 342
GLY A 313
 None
 0.84A 5cdnR-4u7lA:
undetectable
5cdnS-4u7lA:
undetectable		 5cdnR-4u7lA:
22.00
5cdnS-4u7lA:
17.17
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.
4uv2 CURLI PRODUCTION
TRANSPORT COMPONENT
CSGG

(Escherichia
coli) 		PF03783
(CsgG) 		4 GLY A 231
ASP A 230
ARG A 234
GLY A 235
 None
 0.76A 5cdnR-4uv2A:
undetectable
5cdnS-4uv2A:
undetectable		 5cdnR-4uv2A:
20.97
5cdnS-4uv2A:
23.55
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.
4wjv RIBOSOME ASSEMBLY
PROTEIN 4

(Saccharomyces
cerevisiae) 		PF00400
(WD40) 		4 GLY A 414
ASP A 413
ARG A 415
GLY A 431
 None
 0.91A 5cdnR-4wjvA:
undetectable
5cdnS-4wjvA:
undetectable		 5cdnR-4wjvA:
21.46
5cdnS-4wjvA:
18.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4xf5 TWIN-ARGININE
TRANSLOCATION
PATHWAY SIGNAL

(Chromohalobacter
salexigens) 		PF03480
(DctP) 		4 SER A 321
GLU A 322
GLY A 111
ASP A  98
 None
 0.81A 5cdnR-4xf5A:
undetectable
5cdnS-4xf5A:
undetectable		 5cdnR-4xf5A:
22.36
5cdnS-4xf5A:
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.
4ywo MERCURIC REDUCTASE

(Metallosphaera
sedula) 		PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2) 		4 GLU A  91
GLY A 291
ASP A 292
GLY A 304
 None
FAD  A 501 (-3.3A)
FAD  A 501 (-2.7A)
None
 0.88A 5cdnR-4ywoA:
undetectable
5cdnS-4ywoA:
undetectable		 5cdnR-4ywoA:
25.19
5cdnS-4ywoA:
17.79
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.
4zju ENOYL-[ACYL-CARRIER-
PROTEIN] REDUCTASE
[NADH]

(Acinetobacter
baumannii) 		PF13561
(adh_short_C2) 		4 GLU A  79
GLY A 142
ASP A  88
ARG A 140
 None
 0.74A 5cdnR-4zjuA:
undetectable
5cdnS-4zjuA:
3.1		 5cdnR-4zjuA:
18.80
5cdnS-4zjuA:
20.50
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.
5cdo DNA GYRASE SUBUNIT
B,DNA GYRASE SUBUNIT
B

(Staphylococcus
aureus) 		PF00986
(DNA_gyraseB_C)
PF01751
(Toprim) 		4 GLY B 436
ASP B 437
ARG B 458
GLY B 459
 None
 0.65A 5cdnR-5cdoB:
undetectable
5cdnS-5cdoB:
33.8		 5cdnR-5cdoB:
18.03
5cdnS-5cdoB:
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.
5cfa BONE
SIALOPROTEIN-BINDING
PROTEIN

(Staphylococcus
aureus) 		PF10425
(SdrG_C_C) 		4 SER A 277
GLY A 207
ASP A 208
GLY A 197
 None
 0.75A 5cdnR-5cfaA:
undetectable
5cdnS-5cfaA:
undetectable		 5cdnR-5cfaA:
23.46
5cdnS-5cfaA:
19.55
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo sapiens) 		PF00117
(GATase)
PF00988
(CPSase_sm_chain)
PF02142
(MGS)
PF02786
(CPSase_L_D2)
PF02787
(CPSase_L_D3) 		4 GLU A 455
GLY A 509
ASP A 442
GLY A 507
 None
 0.90A 5cdnR-5dotA:
undetectable
5cdnS-5dotA:
2.3		 5cdnR-5dotA:
16.67
5cdnS-5dotA:
8.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5foz LARVICIDAL TOXIN
PROTEIN

(Lysinibacillus
sphaericus) 		PF05431
(Toxin_10) 		4 SER B 335
GLY B 290
ARG B 344
GLY B 342
 None
 0.85A 5cdnR-5fozB:
undetectable
5cdnS-5fozB:
undetectable		 5cdnR-5fozB:
20.86
5cdnS-5fozB:
19.12
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.
5gwj DNA TOPOISOMERASE
2-BETA

(Homo sapiens) 		PF00521
(DNA_topoisoIV)
PF01751
(Toprim)
PF16898
(TOPRIM_C) 		4 GLY A 478
ASP A 479
ARG A 503
GLY A 504
 N2W  A1302 ( 3.0A)
N2W  A1302 ( 3.4A)
N2S  A1301 ( 3.9A)
N2W  A1302 ( 4.4A)
 0.67A 5cdnR-5gwjA:
30.8
5cdnS-5gwjA:
20.4		 5cdnR-5gwjA:
21.66
5cdnS-5gwjA:
12.96
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.
5gwn PROTEIN RCC2

(Homo sapiens) 		PF00415
(RCC1) 		4 GLU A 264
GLY A 185
ASP A 186
GLY A 183
 None
None
SO4  A 603 (-4.4A)
None
 0.87A 5cdnR-5gwnA:
undetectable
5cdnS-5gwnA:
undetectable		 5cdnR-5gwnA:
22.07
5cdnS-5gwnA:
17.85
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.
5gzt CHITINASE

(Paenibacillus
sp. FPU-7) 		no annotation 4 SER A 255
GLU A 256
GLY A 219
GLY A 240
 None
 0.90A 5cdnR-5gztA:
undetectable
5cdnS-5gztA:
undetectable		 5cdnR-5gztA:
13.47
5cdnS-5gztA:
19.55
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5hy7 PUTATIVE PRE-MRNA
SPLICING PROTEIN

(Chaetomium
thermophilum) 		PF03178
(CPSF_A)
PF10433
(MMS1_N) 		4 SER A 420
GLU A 419
GLY A 450
GLY A 448
 None
 0.93A 5cdnR-5hy7A:
undetectable
5cdnS-5hy7A:
undetectable		 5cdnR-5hy7A:
16.83
5cdnS-5hy7A:
9.67
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.
5iaa UBIQUITIN-FOLD
MODIFIER 1
UBIQUITIN-LIKE
MODIFIER-ACTIVATING
ENZYME 5

(Homo sapiens) 		PF00899
(ThiF)
PF03671
(Ufm1) 		4 GLU A 132
GLY C  83
ASP A 183
GLY A  83
 None
 0.88A 5cdnR-5iaaA:
undetectable
5cdnS-5iaaA:
3.7		 5cdnR-5iaaA:
21.38
5cdnS-5iaaA:
20.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5j44 SERINE PROTEASE SEPA
AUTOTRANSPORTER

(Shigella
flexneri) 		PF02395
(Peptidase_S6) 		4 SER A 180
ASP A 219
ARG A 139
GLY A 138
 None
 0.91A 5cdnR-5j44A:
undetectable
5cdnS-5j44A:
undetectable		 5cdnR-5j44A:
18.71
5cdnS-5j44A:
11.41
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.
5jvk UNCHARACTERIZED
PROTEIN

(Bacteroides
cellulosilyticus) 		no annotation 4 SER A 349
GLU A 350
GLY A 284
GLY A 290
 None
 0.90A 5cdnR-5jvkA:
undetectable
5cdnS-5jvkA:
undetectable		 5cdnR-5jvkA:
21.41
5cdnS-5jvkA:
14.97
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.
5jyg ACTIN-LIKE ATPASE

(Magnetospirillum
magneticum) 		PF06723
(MreB_Mbl) 		4 SER A 291
GLY A 150
ARG A 324
GLY A 322
 None
 0.89A 5cdnR-5jygA:
undetectable
5cdnS-5jygA:
undetectable		 5cdnR-5jygA:
22.97
5cdnS-5jygA:
19.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5mpv -

(-) 		no annotation 4 GLY D  86
ASP D  88
ARG D  85
GLY D  84
 None
 0.90A 5cdnR-5mpvD:
undetectable
5cdnS-5mpvD:
undetectable		 5cdnR-5mpvD:
undetectable
5cdnS-5mpvD:
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.
5n2g DNA POLYMERASE

(Vaccinia virus) 		no annotation 4 GLU A 822
GLY A 372
ASP A 373
GLY A 358
 None
 0.92A 5cdnR-5n2gA:
2.5
5cdnS-5n2gA:
undetectable		 5cdnR-5n2gA:
10.17
5cdnS-5n2gA:
17.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5n9m COBYRIC ACID
SYNTHASE

(Staphylococcus
aureus) 		no annotation 4 SER A 124
GLU A 123
GLY A  60
GLY A  96
 None
 0.87A 5cdnR-5n9mA:
undetectable
5cdnS-5n9mA:
undetectable		 5cdnR-5n9mA:
10.57
5cdnS-5n9mA:
16.49
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.
5olj DIPEPTIDYL PEPTIDASE
IV

(Porphyromonas
gingivalis) 		PF00326
(Peptidase_S9)
PF00930
(DPPIV_N) 		4 SER A 566
GLU A 565
GLY A 658
GLY A 613
 None
 0.77A 5cdnR-5oljA:
undetectable
5cdnS-5oljA:
3.5		 5cdnR-5oljA:
21.39
5cdnS-5oljA:
14.68
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.
5ols RHAMNOGALACTURONAN
LYASE

(Bacteroides
thetaiotaomicron) 		no annotation 4 GLU A 276
GLY A 320
ARG A 319
GLY A 341
 None
None
GTR  A 608 (-3.0A)
None
 0.73A 5cdnR-5olsA:
undetectable
5cdnS-5olsA:
undetectable		 5cdnR-5olsA:
20.53
5cdnS-5olsA:
17.37
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.
5t5i TUNGSTEN
FORMYLMETHANOFURAN
DEHYDROGENASE
SUBUNIT FWDG

(Methanothermobacter
wolfeii) 		PF12838
(Fer4_7) 		4 SER G  70
GLU G  69
GLY G  37
GLY G  35
 SF4  G 101 ( 4.4A)
None
None
None
 0.87A 5cdnR-5t5iG:
undetectable
5cdnS-5t5iG:
undetectable		 5cdnR-5t5iG:
12.05
5cdnS-5t5iG:
19.21
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.
6brd RIFAMPIN
MONOOXYGENASE

(Streptomyces
venezuelae) 		no annotation 4 SER A 436
GLU A 437
GLY A 450
ARG A 391
 None
 0.92A 5cdnR-6brdA:
undetectable
5cdnS-6brdA:
undetectable		 5cdnR-6brdA:
11.09
5cdnS-6brdA:
19.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6bu3 BETA-LACTAMASE

(Escherichia
coli) 		no annotation 4 SER A  27
GLY A  45
ARG A  61
GLY A  62
 None
 0.84A 5cdnR-6bu3A:
undetectable
5cdnS-6bu3A:
undetectable		 5cdnR-6bu3A:
9.79
5cdnS-6bu3A:
17.55
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.
6c01 ECTONUCLEOTIDE
PYROPHOSPHATASE/PHOS
PHODIESTERASE FAMILY
MEMBER 3

(Homo sapiens) 		no annotation 4 GLU A 516
GLY A 168
ASP A 167
GLY A 374
 None
None
ZN  A 902 (-2.0A)
None
 0.89A 5cdnR-6c01A:
2.9
5cdnS-6c01A:
undetectable		 5cdnR-6c01A:
10.82
5cdnS-6c01A:
13.98
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.
6c6l V-TYPE PROTON ATPASE
SUBUNIT D

(Saccharomyces
cerevisiae) 		no annotation 4 GLU B 317
GLY B  15
ARG B  18
GLY B  19
 None
 0.89A 5cdnR-6c6lB:
1.3
5cdnS-6c6lB:
undetectable		 5cdnR-6c6lB:
9.11
5cdnS-6c6lB:
15.93
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.
6cim V(D)J
RECOMBINATION-ACTIVA
TING PROTEIN 2

(Mus musculus) 		no annotation 4 GLU B 126
GLY B  18
ARG B  73
GLY B  32
 None
 0.89A 5cdnR-6cimB:
undetectable
5cdnS-6cimB:
undetectable		 5cdnR-6cimB:
10.82
5cdnS-6cimB:
13.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6eq8 PERIPLASMIC
ALPHA-GALACTOSIDE-BI
NDING PROTEIN

(Agrobacterium
tumefaciens) 		no annotation 4 GLU D 495
GLY D 463
ASP D 462
GLY D 505
 None
EDO  D 703 (-3.8A)
CA  D 709 ( 2.9A)
None
 0.84A 5cdnR-6eq8D:
5.2
5cdnS-6eq8D:
undetectable		 5cdnR-6eq8D:
11.14
5cdnS-6eq8D:
18.92