SIMILAR PATTERNS OF AMINO ACIDS FOR 5ICX_E_SC2E1_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.
1e4o MALTODEXTRIN
PHOSPHORYLASE

(Escherichia
coli) 		PF00343
(Phosphorylase) 		3 VAL A 179
GLN A 275
CYH A 278
 None
 0.74A 5icxA-1e4oA:
0.0
5icxE-1e4oA:
undetectable		 5icxA-1e4oA:
14.66
5icxE-1e4oA:
1.76
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.
1g5i MITOCHONDRIAL DNA
POLYMERASE ACCESSORY
SUBUNIT

(Mus musculus) 		PF03129
(HGTP_anticodon) 		3 VAL A 417
GLN A 371
CYH A 373
 None
 0.70A 5icxA-1g5iA:
1.7
5icxE-1g5iA:
undetectable		 5icxA-1g5iA:
19.78
5icxE-1g5iA:
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.
1i1q ANTHRANILATE
SYNTHASE COMPONENT I

(Salmonella
enterica) 		PF00425
(Chorismate_bind)
PF04715
(Anth_synt_I_N) 		3 VAL A  55
GLN A  27
CYH A  29
 None
 0.82A 5icxA-1i1qA:
0.2
5icxE-1i1qA:
undetectable		 5icxA-1i1qA:
18.24
5icxE-1i1qA:
3.48
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.
1kae HISTIDINOL
DEHYDROGENASE

(Escherichia
coli) 		PF00815
(Histidinol_dh) 		3 VAL A  92
GLN A 174
CYH A 176
 None
 0.78A 5icxA-1kaeA:
0.0
5icxE-1kaeA:
undetectable		 5icxA-1kaeA:
22.92
5icxE-1kaeA:
9.03
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.
1kbz DTDP-GLUCOSE
OXIDOREDUCTASE

(Salmonella
enterica) 		PF04321
(RmlD_sub_bind) 		3 VAL A  99
GLN A 140
CYH A 143
 None
 0.72A 5icxA-1kbzA:
0.0
5icxE-1kbzA:
undetectable		 5icxA-1kbzA:
21.40
5icxE-1kbzA:
3.83
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.
1o91 COLLAGEN ALPHA
1(VIII) CHAIN

(Mus musculus) 		PF00386
(C1q) 		3 VAL A 673
GLN A 698
CYH A 668
 None
 0.75A 5icxA-1o91A:
undetectable
5icxE-1o91A:
undetectable		 5icxA-1o91A:
22.42
5icxE-1o91A:
5.92
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.
1oqa BREAST CANCER TYPE 1
SUSCEPTIBILITY
PROTEIN

(Homo sapiens) 		PF00533
(BRCT) 		3 VAL A  79
GLN A  73
CYH A  75
 None
 0.76A 5icxA-1oqaA:
0.0
5icxE-1oqaA:
undetectable		 5icxA-1oqaA:
21.11
5icxE-1oqaA:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1pgw BEAN POD MOTTLE
VIRUS LARGE (L)
SUBUNIT

(Bean pod mottle
virus) 		PF02247
(Como_LCP) 		3 VAL 2 330
GLN 2 204
CYH 2 260
 None
 0.81A 5icxA-1pgw2:
0.0
5icxE-1pgw2:
undetectable		 5icxA-1pgw2:
23.26
5icxE-1pgw2:
5.15
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.
1rcd L FERRITIN

(Rana
catesbeiana) 		PF00210
(Ferritin) 		3 VAL A 116
GLN A  10
CYH A  12
 None
 0.70A 5icxA-1rcdA:
undetectable
5icxE-1rcdA:
undetectable		 5icxA-1rcdA:
21.36
5icxE-1rcdA:
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.
1s72 50S RIBOSOMAL
PROTEIN L10E

(Haloarcula
marismortui) 		PF00252
(Ribosomal_L16) 		3 VAL H 146
GLN H  46
CYH H 138
 None
 0.77A 5icxA-1s72H:
0.0
5icxE-1s72H:
undetectable		 5icxA-1s72H:
19.46
5icxE-1s72H:
5.85
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.
1u00 CHAPERONE PROTEIN
HSCA

(Escherichia
coli) 		PF00012
(HSP70) 		3 VAL A 405
GLN A 439
CYH A 448
 None
 0.63A 5icxA-1u00A:
undetectable
5icxE-1u00A:
undetectable		 5icxA-1u00A:
21.25
5icxE-1u00A:
4.00
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.
1wij ETHYLENE-INSENSITIVE
3-LIKE 3 PROTEIN

(Arabidopsis
thaliana) 		PF04873
(EIN3) 		3 VAL A 242
GLN A 183
CYH A 185
 None
 0.80A 5icxA-1wijA:
undetectable
5icxE-1wijA:
undetectable		 5icxA-1wijA:
21.86
5icxE-1wijA:
10.28
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.
1wlf PEROXISOME
BIOGENESIS FACTOR 1

(Mus musculus) 		PF09262
(PEX-1N)
PF09263
(PEX-2N) 		3 VAL A 137
GLN A 105
CYH A 103
 None
 0.63A 5icxA-1wlfA:
undetectable
5icxE-1wlfA:
undetectable		 5icxA-1wlfA:
21.60
5icxE-1wlfA:
11.11
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.
1x3w PEPTIDE:N-GLYCANASE

(Saccharomyces
cerevisiae) 		PF03835
(Rad4) 		3 VAL A 266
GLN A  60
CYH A  63
 None
 0.77A 5icxA-1x3wA:
undetectable
5icxE-1x3wA:
undetectable		 5icxA-1x3wA:
21.43
5icxE-1x3wA:
4.92
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.
1x9s DNA POLYMERASE

(Escherichia
virus T7) 		PF00476
(DNA_pol_A) 		3 VAL A 669
GLN A 471
CYH A 660
 None
 0.72A 5icxA-1x9sA:
undetectable
5icxE-1x9sA:
undetectable		 5icxA-1x9sA:
15.32
5icxE-1x9sA:
2.19
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.
1xm9 PLAKOPHILIN 1

(Homo sapiens) 		PF00514
(Arm) 		3 VAL A 283
GLN A 270
CYH A 273
 None
 0.43A 5icxA-1xm9A:
undetectable
5icxE-1xm9A:
undetectable		 5icxA-1xm9A:
19.29
5icxE-1xm9A:
4.73
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.
2aex COPROPORPHYRINOGEN
III OXIDASE,
MITOCHONDRIAL

(Homo sapiens) 		PF01218
(Coprogen_oxidas) 		3 VAL A 205
GLN A 162
CYH A 164
 None
 0.71A 5icxA-2aexA:
undetectable
5icxE-2aexA:
undetectable		 5icxA-2aexA:
20.29
5icxE-2aexA:
3.94
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.
2bra NEDD9 INTERACTING
PROTEIN WITH
CALPONIN HOMOLOGY
AND LIM DOMAINS

(Mus musculus) 		PF01494
(FAD_binding_3) 		3 VAL A 406
GLN A 161
CYH A  95
 None
None
FAD  A1485 (-3.5A)
 0.84A 5icxA-2braA:
undetectable
5icxE-2braA:
undetectable		 5icxA-2braA:
18.38
5icxE-2braA:
4.98
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.
2c7s RECEPTOR-TYPE
TYROSINE-PROTEIN
PHOSPHATASE KAPPA

(Homo sapiens) 		PF00102
(Y_phosphatase) 		3 VAL A1068
GLN A1043
CYH A 981
 None
 0.58A 5icxA-2c7sA:
undetectable
5icxE-2c7sA:
undetectable		 5icxA-2c7sA:
18.69
5icxE-2c7sA:
3.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2dfv PROBABLE L-THREONINE
3-DEHYDROGENASE

(Pyrococcus
horikoshii) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		3 VAL A  96
GLN A 107
CYH A 103
 None
None
ZN  A1001 (-2.2A)
 0.72A 5icxA-2dfvA:
undetectable
5icxE-2dfvA:
undetectable		 5icxA-2dfvA:
20.11
5icxE-2dfvA:
3.46
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.
2do9 NACHT-, LRR- AND
PYD-CONTAINING
PROTEIN 10

(Mus musculus) 		PF02758
(PYRIN) 		3 VAL A  74
GLN A  95
CYH A  97
 None
 0.65A 5icxA-2do9A:
undetectable
5icxE-2do9A:
undetectable		 5icxA-2do9A:
20.93
5icxE-2do9A:
8.70
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.
2gie TYPE II RESTRICTION
ENZYME HINCII

(Haemophilus
influenzae) 		PF09226
(Endonuc-HincII) 		3 VAL A 171
GLN A  18
CYH A 182
 None
 0.71A 5icxA-2gieA:
undetectable
5icxE-2gieA:
undetectable		 5icxA-2gieA:
18.25
5icxE-2gieA:
5.19
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.
2iuw ALKYLATED REPAIR
PROTEIN ALKB HOMOLOG
3

(Homo sapiens) 		PF13532
(2OG-FeII_Oxy_2) 		3 VAL A 270
GLN A 108
CYH A 110
 None
None
BME  A 802 (-1.9A)
 0.68A 5icxA-2iuwA:
undetectable
5icxE-2iuwA:
undetectable		 5icxA-2iuwA:
21.40
5icxE-2iuwA:
4.20
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.
2jgd 2-OXOGLUTARATE
DEHYDROGENASE E1
COMPONENT

(Escherichia
coli) 		PF00676
(E1_dh)
PF02779
(Transket_pyr)
PF16870
(OxoGdeHyase_C) 		3 VAL A 748
GLN A 739
CYH A 741
 None
 0.75A 5icxA-2jgdA:
undetectable
5icxE-2jgdA:
undetectable		 5icxA-2jgdA:
12.68
5icxE-2jgdA:
3.74
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.
2qlu ACTIVIN RECEPTOR
TYPE IIB

(Homo sapiens) 		PF00069
(Pkinase) 		3 VAL A 397
GLN A 452
CYH A 454
 None
 0.84A 5icxA-2qluA:
undetectable
5icxE-2qluA:
undetectable		 5icxA-2qluA:
20.44
5icxE-2qluA:
5.75
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.
2qmw PREPHENATE
DEHYDRATASE

(Staphylococcus
aureus) 		PF00800
(PDT) 		3 VAL A  50
GLN A  19
CYH A  17
 None
 0.72A 5icxA-2qmwA:
undetectable
5icxE-2qmwA:
undetectable		 5icxA-2qmwA:
23.57
5icxE-2qmwA:
3.75
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.
2vqd BIOTIN CARBOXYLASE

(Pseudomonas
aeruginosa) 		PF00289
(Biotin_carb_N)
PF02785
(Biotin_carb_C)
PF02786
(CPSase_L_D2) 		3 VAL A 214
GLN A 262
CYH A 264
 None
 0.82A 5icxA-2vqdA:
undetectable
5icxE-2vqdA:
undetectable		 5icxA-2vqdA:
19.48
5icxE-2vqdA:
3.62
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.
2w9z G1/S-SPECIFIC
CYCLIN-D1

(Homo sapiens) 		PF00134
(Cyclin_N)
PF02984
(Cyclin_C) 		3 VAL A  77
GLN A  71
CYH A  68
 None
 0.84A 5icxA-2w9zA:
undetectable
5icxE-2w9zA:
undetectable		 5icxA-2w9zA:
23.95
5icxE-2w9zA:
4.48
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.
2xgo XCOGT

(Xanthomonas
campestris) 		PF13432
(TPR_16)
PF13844
(Glyco_transf_41) 		3 VAL A 162
GLN A 177
CYH A 180
 None
 0.79A 5icxA-2xgoA:
undetectable
5icxE-2xgoA:
undetectable		 5icxA-2xgoA:
17.24
5icxE-2xgoA:
2.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2yf0 MYOTUBULARIN-RELATED
PROTEIN 6

(Homo sapiens) 		PF06602
(Myotub-related) 		3 VAL A 334
GLN A 345
CYH A 347
 None
 0.77A 5icxA-2yf0A:
undetectable
5icxE-2yf0A:
undetectable		 5icxA-2yf0A:
18.90
5icxE-2yf0A:
3.16
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.
3a05 TRYPTOPHANYL-TRNA
SYNTHETASE

(Aeropyrum
pernix) 		PF00579
(tRNA-synt_1b) 		3 VAL A 305
GLN A 339
CYH A 337
 SF4  A 373 ( 4.3A)
None
SF4  A 373 (-2.2A)
 0.83A 5icxA-3a05A:
undetectable
5icxE-3a05A:
undetectable		 5icxA-3a05A:
20.93
5icxE-3a05A:
3.85
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.
3bkx SAM-DEPENDENT
METHYLTRANSFERASE

(Lactobacillus
paracasei) 		PF13649
(Methyltransf_25) 		3 VAL A 104
GLN A  53
CYH A  51
 None
 0.84A 5icxA-3bkxA:
undetectable
5icxE-3bkxA:
undetectable		 5icxA-3bkxA:
19.93
5icxE-3bkxA:
4.79
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.
3bwt PROTEIN PUF4

(Saccharomyces
cerevisiae) 		PF00806
(PUF) 		3 VAL A 669
GLN A 654
CYH A 693
 None
 0.69A 5icxA-3bwtA:
undetectable
5icxE-3bwtA:
undetectable		 5icxA-3bwtA:
20.85
5icxE-3bwtA:
5.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3dmy PROTEIN FDRA

(Escherichia
coli) 		PF00549
(Ligase_CoA)
PF02629
(CoA_binding) 		3 VAL A 198
GLN A 207
CYH A 210
 None
 0.80A 5icxA-3dmyA:
undetectable
5icxE-3dmyA:
undetectable		 5icxA-3dmyA:
18.91
5icxE-3dmyA:
3.12
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.
3eh0 UDP-3-O-[3-HYDROXYMY
RISTOYL] GLUCOSAMINE
N-ACYLTRANSFERASE

(Escherichia
coli) 		PF00132
(Hexapep)
PF04613
(LpxD)
PF14602
(Hexapep_2) 		3 VAL A 249
GLN A 236
CYH A 235
 None
 0.83A 5icxA-3eh0A:
undetectable
5icxE-3eh0A:
undetectable		 5icxA-3eh0A:
21.13
5icxE-3eh0A:
4.27
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.
3eo7 PUTATIVE
NITROREDUCTASE

(Trichormus
variabilis) 		PF00881
(Nitroreductase) 		3 VAL A 233
GLN A 147
CYH A 150
 None
 0.79A 5icxA-3eo7A:
undetectable
5icxE-3eo7A:
undetectable		 5icxA-3eo7A:
17.20
5icxE-3eo7A:
3.17
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.
3eup TRANSCRIPTIONAL
REGULATOR, TETR
FAMILY

(Cytophaga
hutchinsonii) 		PF00440
(TetR_N) 		3 VAL A  88
GLN A  77
CYH A  79
 None
 0.83A 5icxA-3eupA:
undetectable
5icxE-3eupA:
undetectable		 5icxA-3eupA:
18.64
5icxE-3eupA:
4.41
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.
3glg DNA POLYMERASE III
SUBUNIT DELTA

(Escherichia
coli) 		PF06144
(DNA_pol3_delta)
PF14840
(DNA_pol3_delt_C) 		3 VAL A 151
GLN A 168
CYH A 171
 None
 0.77A 5icxA-3glgA:
undetectable
5icxE-3glgA:
undetectable		 5icxA-3glgA:
20.93
5icxE-3glgA:
4.21
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.
3gs3 SYMPLEKIN

(Drosophila
melanogaster) 		PF11935
(DUF3453) 		3 VAL A 104
GLN A  92
CYH A  94
 None
 0.81A 5icxA-3gs3A:
undetectable
5icxE-3gs3A:
undetectable		 5icxA-3gs3A:
21.92
5icxE-3gs3A:
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.
3j4r CAMP-DEPENDENT
PROTEIN KINASE TYPE
II-ALPHA REGULATORY
SUBUNIT

(Mus musculus) 		PF00027
(cNMP_binding)
PF02197
(RIIa) 		3 VAL B 176
GLN B 129
CYH B 132
 None
 0.79A 5icxA-3j4rB:
undetectable
5icxE-3j4rB:
undetectable		 5icxA-3j4rB:
18.91
5icxE-3j4rB:
4.50
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.
3k1i PUTATIVE
UNCHARACTERIZED
PROTEIN

(Helicobacter
pylori) 		PF16522
(FliS_cochap) 		3 VAL C 111
GLN C  51
CYH C  54
 None
 0.83A 5icxA-3k1iC:
undetectable
5icxE-3k1iC:
undetectable		 5icxA-3k1iC:
21.92
5icxE-3k1iC:
4.02
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.
3llm ATP-DEPENDENT RNA
HELICASE A

(Homo sapiens) 		PF00270
(DEAD) 		3 VAL A 563
GLN A 420
CYH A 415
 None
None
ADP  A 565 (-4.8A)
 0.60A 5icxA-3llmA:
undetectable
5icxE-3llmA:
undetectable		 5icxA-3llmA:
22.04
5icxE-3llmA:
6.51
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.
3mog PROBABLE
3-HYDROXYBUTYRYL-COA
DEHYDROGENASE

(Escherichia
coli) 		PF00725
(3HCDH)
PF02737
(3HCDH_N) 		3 VAL A 155
GLN A 168
CYH A 170
 None
 0.80A 5icxA-3mogA:
undetectable
5icxE-3mogA:
undetectable		 5icxA-3mogA:
19.87
5icxE-3mogA:
3.54
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3mqt MANDELATE
RACEMASE/MUCONATE
LACTONIZING PROTEIN

(Shewanella
pealeana) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		3 VAL A 279
GLN A 268
CYH A 299
 None
 0.77A 5icxA-3mqtA:
undetectable
5icxE-3mqtA:
undetectable		 5icxA-3mqtA:
18.48
5icxE-3mqtA:
3.94
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.
3mz1 PUTATIVE
TRANSCRIPTIONAL
REGULATOR

(Sinorhizobium
meliloti) 		PF03466
(LysR_substrate) 		3 VAL A 241
GLN A 235
CYH A 160
 None
 0.77A 5icxA-3mz1A:
undetectable
5icxE-3mz1A:
undetectable		 5icxA-3mz1A:
22.26
5icxE-3mz1A:
3.33
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3noj 4-CARBOXY-4-HYDROXY-
2-OXOADIPATE
ALDOLASE/OXALOACETAT
E DECARBOXYLASE

(Pseudomonas
putida) 		PF03737
(RraA-like) 		3 VAL A  88
GLN A 162
CYH A 159
 None
 0.54A 5icxA-3nojA:
undetectable
5icxE-3nojA:
undetectable		 5icxA-3nojA:
19.18
5icxE-3nojA:
6.44
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3nyf D-ARGININE
DEHYDROGENASE

(Pseudomonas
aeruginosa) 		PF01266
(DAO) 		3 VAL A1133
GLN A1120
CYH A1122
 None
 0.72A 5icxA-3nyfA:
undetectable
5icxE-3nyfA:
undetectable		 5icxA-3nyfA:
19.90
5icxE-3nyfA:
3.41
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.
3oc4 OXIDOREDUCTASE,
PYRIDINE
NUCLEOTIDE-DISULFIDE
FAMILY

(Enterococcus
faecalis) 		PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2) 		3 VAL A 193
GLN A 384
CYH A 386
 None
 0.83A 5icxA-3oc4A:
undetectable
5icxE-3oc4A:
undetectable		 5icxA-3oc4A:
18.99
5icxE-3oc4A:
2.82
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.
3opy 6-PHOSPHOFRUCTO-1-KI
NASE BETA-SUBUNIT

(Komagataella
pastoris) 		PF00365
(PFK) 		3 VAL B 450
GLN B 410
CYH B 412
 None
ATP  B 942 (-3.6A)
None
 0.71A 5icxA-3opyB:
undetectable
5icxE-3opyB:
undetectable		 5icxA-3opyB:
14.10
5icxE-3opyB:
2.27
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.
3qi6 CYSTATHIONINE
GAMMA-SYNTHASE METB
(CGS)

(Mycobacterium
ulcerans) 		PF01053
(Cys_Met_Meta_PP) 		3 VAL A 367
GLN A 323
CYH A 325
 None
 0.60A 5icxA-3qi6A:
undetectable
5icxE-3qi6A:
undetectable		 5icxA-3qi6A:
19.27
5icxE-3qi6A:
3.35
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.
3rde ARACHIDONATE
12-LIPOXYGENASE,
12S-TYPE

(Sus scrofa) 		PF00305
(Lipoxygenase) 		3 VAL A 480
GLN A 525
CYH A 527
 None
 0.81A 5icxA-3rdeA:
undetectable
5icxE-3rdeA:
undetectable		 5icxA-3rdeA:
16.91
5icxE-3rdeA:
3.46
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.
3smd MUTT/NUDIX FAMILY
PROTEIN

(Bacillus
thuringiensis) 		PF00293
(NUDIX) 		3 VAL A  66
GLN A  75
CYH A 107
 None
 0.75A 5icxA-3smdA:
undetectable
5icxE-3smdA:
undetectable		 5icxA-3smdA:
22.07
5icxE-3smdA:
9.59
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.
3thz DNA MISMATCH REPAIR
PROTEIN MSH2

(Homo sapiens) 		PF00488
(MutS_V)
PF01624
(MutS_I)
PF05188
(MutS_II)
PF05190
(MutS_IV)
PF05192
(MutS_III) 		3 VAL A 582
GLN A 402
CYH A 404
 None
 0.75A 5icxA-3thzA:
undetectable
5icxE-3thzA:
undetectable		 5icxA-3thzA:
13.48
5icxE-3thzA:
1.57
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.
3tt9 PLAKOPHILIN-2

(Homo sapiens) 		PF00514
(Arm) 		3 VAL A 391
GLN A 378
CYH A 381
 None
 0.71A 5icxA-3tt9A:
undetectable
5icxE-3tt9A:
undetectable		 5icxA-3tt9A:
19.76
5icxE-3tt9A:
5.12
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.
3uwa RIIA-RIIB
MEMBRANE-ASSOCIATED
PROTEIN

(Synechococcus
phage S-SSM7) 		PF01327
(Pep_deformylase) 		3 VAL A  58
GLN A  32
CYH A  34
 None
 0.76A 5icxA-3uwaA:
undetectable
5icxE-3uwaA:
undetectable		 5icxA-3uwaA:
20.91
5icxE-3uwaA:
7.44
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3vpi TYPE VI SECRETION
EXPORTED 1

(Pseudomonas
aeruginosa) 		no annotation 3 VAL A 129
GLN A 121
CYH A 110
 None
 0.82A 5icxA-3vpiA:
undetectable
5icxE-3vpiA:
undetectable		 5icxA-3vpiA:
20.09
5icxE-3vpiA:
5.56
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.
3zj0 ACETYLTRANSFERASE

(Oceanicola
granulosus) 		PF00583
(Acetyltransf_1) 		3 VAL A   5
GLN A 143
CYH A  68
 None
ACO  A1205 (-3.7A)
None
 0.83A 5icxA-3zj0A:
undetectable
5icxE-3zj0A:
undetectable		 5icxA-3zj0A:
16.37
5icxE-3zj0A:
9.09
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.
4b9w TUDOR
DOMAIN-CONTAINING
PROTEIN 1

(Mus musculus) 		PF00567
(TUDOR) 		3 VAL A 789
GLN A 806
CYH A 763
 None
 0.83A 5icxA-4b9wA:
undetectable
5icxE-4b9wA:
undetectable		 5icxA-4b9wA:
20.88
5icxE-4b9wA:
5.47
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.
4c2k 3-KETOACYL-COA
THIOLASE,
MITOCHONDRIAL

(Homo sapiens) 		PF00108
(Thiolase_N)
PF02803
(Thiolase_C) 		3 VAL A   7
GLN A 104
CYH A 107
 None
 0.72A 5icxA-4c2kA:
undetectable
5icxE-4c2kA:
undetectable		 5icxA-4c2kA:
18.57
5icxE-4c2kA:
3.61
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.
4c3h DNA-DIRECTED RNA
POLYMERASE I SUBUNIT
RPA190

(Saccharomyces
cerevisiae) 		PF00623
(RNA_pol_Rpb1_2)
PF04983
(RNA_pol_Rpb1_3)
PF04997
(RNA_pol_Rpb1_1)
PF04998
(RNA_pol_Rpb1_5)
PF05000
(RNA_pol_Rpb1_4) 		3 VAL A 912
GLN A 942
CYH A 945
 None
 0.47A 5icxA-4c3hA:
3.7
5icxE-4c3hA:
undetectable		 5icxA-4c3hA:
8.53
5icxE-4c3hA:
1.36
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.
4c3z MULTIDRUG
RESISTANCE-ASSOCIATE
D PROTEIN 1

(Homo sapiens) 		PF00005
(ABC_tran) 		3 VAL A 782
GLN A 742
CYH A 744
 None
 0.83A 5icxA-4c3zA:
undetectable
5icxE-4c3zA:
undetectable		 5icxA-4c3zA:
20.59
5icxE-4c3zA:
4.28
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.
4eqa PUTATIVE
UNCHARACTERIZED
PROTEIN

(Pseudomonas
aeruginosa) 		no annotation 3 VAL A 129
GLN A 121
CYH A 110
 None
 0.68A 5icxA-4eqaA:
undetectable
5icxE-4eqaA:
undetectable		 5icxA-4eqaA:
19.61
5icxE-4eqaA:
5.48
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.
4f4m PAPAIN PEPTIDOGLYCAN
AMIDASE EFFECTOR
TSE1

(Pseudomonas
aeruginosa) 		no annotation 3 VAL A 129
GLN A 121
CYH A 110
 None
 0.84A 5icxA-4f4mA:
undetectable
5icxE-4f4mA:
undetectable		 5icxA-4f4mA:
22.22
5icxE-4f4mA:
6.45
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.
4fhn NUCLEOPORIN NUP120

(Schizosaccharomyces
pombe) 		PF11715
(Nup160) 		3 VAL B1013
GLN B1016
CYH B1018
 None
 0.83A 5icxA-4fhnB:
undetectable
5icxE-4fhnB:
undetectable		 5icxA-4fhnB:
12.79
5icxE-4fhnB:
1.75
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.
4fxd DNA POLYMERASE ALPHA
CATALYTIC SUBUNIT A

(Saccharomyces
cerevisiae) 		PF00136
(DNA_pol_B)
PF03104
(DNA_pol_B_exo1) 		3 VAL A 764
GLN A 721
CYH A 724
 None
 0.52A 5icxA-4fxdA:
undetectable
5icxE-4fxdA:
undetectable		 5icxA-4fxdA:
14.05
5icxE-4fxdA:
3.05
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.
4gek TRNA
(CMO5U34)-METHYLTRAN
SFERASE

(Escherichia
coli) 		PF13649
(Methyltransf_25) 		3 VAL A  54
GLN A  59
CYH A  83
 None
 0.78A 5icxA-4gekA:
undetectable
5icxE-4gekA:
undetectable		 5icxA-4gekA:
20.60
5icxE-4gekA:
6.70
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.
4imi SYMPLEKIN

(Drosophila
melanogaster) 		PF11935
(DUF3453) 		3 VAL A 104
GLN A  92
CYH A  94
 None
 0.80A 5icxA-4imiA:
undetectable
5icxE-4imiA:
undetectable		 5icxA-4imiA:
22.45
5icxE-4imiA:
3.48
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.
4iwn TRNA
(CMO5U34)-METHYLTRAN
SFERASE

(Escherichia
coli) 		PF13649
(Methyltransf_25) 		3 VAL A  54
GLN A  59
CYH A  83
 None
 0.78A 5icxA-4iwnA:
undetectable
5icxE-4iwnA:
undetectable		 5icxA-4iwnA:
21.31
5icxE-4iwnA:
8.11
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.
4j25 PUTATIVE
UNCHARACTERIZED
PROTEIN

(Pseudomonas
putida) 		PF13640
(2OG-FeII_Oxy_3) 		3 VAL A 166
GLN A  25
CYH A 172
 None
 0.77A 5icxA-4j25A:
undetectable
5icxE-4j25A:
undetectable		 5icxA-4j25A:
19.83
5icxE-4j25A:
5.47
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.
4kw2 UNCHARACTERIZED
PROTEIN

(Parabacteroides
distasonis) 		PF01261
(AP_endonuc_2) 		3 VAL A 233
GLN A 267
CYH A 269
 None
EDO  A 307 ( 4.9A)
None
 0.82A 5icxA-4kw2A:
undetectable
5icxE-4kw2A:
undetectable		 5icxA-4kw2A:
22.30
5icxE-4kw2A:
3.40
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.
4l1k D-ALANINE--D-ALANINE
LIGASE

(Xanthomonas
oryzae) 		PF01820
(Dala_Dala_lig_N)
PF07478
(Dala_Dala_lig_C) 		3 VAL A 316
GLN A 291
CYH A 295
 None
 0.68A 5icxA-4l1kA:
undetectable
5icxE-4l1kA:
undetectable		 5icxA-4l1kA:
19.79
5icxE-4l1kA:
3.75
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.
4mdr AP-4 COMPLEX SUBUNIT
MU-1

(Homo sapiens) 		PF00928
(Adap_comp_sub) 		3 VAL A 368
GLN A 373
CYH A 319
 None
 0.83A 5icxA-4mdrA:
2.9
5icxE-4mdrA:
undetectable		 5icxA-4mdrA:
22.79
5icxE-4mdrA:
4.20
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.
4n0r PUTATIVE GLYCOSIDE
HYDROLASE

(Bacteroides
vulgatus) 		PF13204
(DUF4038)
PF16586
(DUF5060) 		3 VAL A 333
GLN A 328
CYH A 352
 None
NI  A 602 (-2.7A)
None
 0.51A 5icxA-4n0rA:
4.1
5icxE-4n0rA:
undetectable		 5icxA-4n0rA:
19.20
5icxE-4n0rA:
2.92
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.
4nlh TAX1-BINDING PROTEIN
1

(Homo sapiens) 		PF07888
(CALCOCO1) 		3 VAL A  50
GLN A  20
CYH A  34
 None
 0.85A 5icxA-4nlhA:
5.7
5icxE-4nlhA:
undetectable		 5icxA-4nlhA:
20.83
5icxE-4nlhA:
7.30
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4p08 COCAINE ESTERASE

(Rhodococcus sp.
MB1) 		PF02129
(Peptidase_S15)
PF08530
(PepX_C) 		3 VAL A 111
GLN A 104
CYH A 107
 None
 0.76A 5icxA-4p08A:
undetectable
5icxE-4p08A:
undetectable		 5icxA-4p08A:
17.38
5icxE-4p08A:
2.83
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.
4y7i MYOTUBULARIN-RELATED
PROTEIN 8

(Homo sapiens) 		PF06602
(Myotub-related) 		3 VAL A 336
GLN A 347
CYH A 349
 None
 0.70A 5icxA-4y7iA:
undetectable
5icxE-4y7iA:
undetectable		 5icxA-4y7iA:
19.63
5icxE-4y7iA:
5.51
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.
4y9l PROTEIN ACDH-11,
ISOFORM B

(Caenorhabditis
elegans) 		PF00441
(Acyl-CoA_dh_1)
PF02770
(Acyl-CoA_dh_M) 		3 VAL A 160
GLN A 121
CYH A 123
 None
 0.83A 5icxA-4y9lA:
undetectable
5icxE-4y9lA:
undetectable		 5icxA-4y9lA:
15.97
5icxE-4y9lA:
3.05
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.
4ztu DNA POLYMERASE
SUBUNIT GAMMA-2,
MITOCHONDRIAL

(Homo sapiens) 		PF03129
(HGTP_anticodon) 		3 VAL B 443
GLN B 397
CYH B 399
 None
 0.78A 5icxA-4ztuB:
1.7
5icxE-4ztuB:
undetectable		 5icxA-4ztuB:
17.93
5icxE-4ztuB:
3.44
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5a31 ANAPHASE-PROMOTING
COMPLEX SUBUNIT 1

(Homo sapiens) 		PF12859
(ANAPC1) 		3 VAL A1047
GLN A1072
CYH A1074
 None
 0.80A 5icxA-5a31A:
undetectable
5icxE-5a31A:
undetectable		 5icxA-5a31A:
9.48
5icxE-5a31A:
1.32
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.
5c53 POL GAMMA B

(Homo sapiens) 		PF03129
(HGTP_anticodon) 		3 VAL B 443
GLN B 397
CYH B 399
 None
 0.80A 5icxA-5c53B:
1.8
5icxE-5c53B:
undetectable		 5icxA-5c53B:
13.00
5icxE-5c53B:
1.65
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.
5e8c UL34 PROTEIN

(Suid
alphaherpesvirus
1) 		PF04541
(Herpes_U34) 		3 VAL B   6
GLN B  39
CYH B  20
 None
 0.66A 5icxA-5e8cB:
undetectable
5icxE-5e8cB:
undetectable		 5icxA-5e8cB:
21.46
5icxE-5e8cB:
8.09
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.
5eix DNA TOPOISOMERASE 4
SUBUNIT B,DNA
TOPOISOMERASE 4
SUBUNIT A

(Klebsiella
pneumoniae) 		PF00521
(DNA_topoisoIV)
PF00986
(DNA_gyraseB_C)
PF01751
(Toprim) 		3 VAL A1070
GLN A1042
CYH A1082
 None
 0.84A 5icxA-5eixA:
undetectable
5icxE-5eixA:
undetectable		 5icxA-5eixA:
14.19
5icxE-5eixA:
3.49
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.
5fo1 RIBOFLAVIN
BIOSYNTHESIS PROTEIN
RIBF

(Corynebacterium
ammoniagenes) 		PF01687
(Flavokinase)
PF06574
(FAD_syn) 		3 VAL A 107
GLN A 141
CYH A 143
 None
 0.58A 5icxA-5fo1A:
undetectable
5icxE-5fo1A:
undetectable		 5icxA-5fo1A:
24.77
5icxE-5fo1A:
5.45
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.
5guj DNA PRIMASE

(Bacillus
subtilis) 		PF08275
(Toprim_N)
PF10410
(DnaB_bind)
PF13155
(Toprim_2) 		3 VAL A 297
GLN A 329
CYH A 333
 None
 0.61A 5icxA-5gujA:
undetectable
5icxE-5gujA:
undetectable		 5icxA-5gujA:
22.62
5icxE-5gujA:
5.69
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.
5hb4 NUP192,NUCLEOPORIN
NUP192

(Chaetomium
thermophilum) 		PF11894
(Nup192) 		3 VAL B 768
GLN B 724
CYH B 789
 None
 0.69A 5icxA-5hb4B:
undetectable
5icxE-5hb4B:
undetectable		 5icxA-5hb4B:
9.37
5icxE-5hb4B:
0.91
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.
5huc 3-DEOXY-D-ARABINO-HE
PTULOSONATE
7-PHOSPHATE (DAHP)
SYNTHASE

(Corynebacterium
glutamicum) 		PF01474
(DAHP_synth_2) 		3 VAL A  69
GLN A 288
CYH A 255
 None
 0.82A 5icxA-5hucA:
undetectable
5icxE-5hucA:
undetectable		 5icxA-5hucA:
17.90
5icxE-5hucA:
3.51
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.
5ikj CRYPTIC LOCI
REGULATOR 2

(Schizosaccharomyces
pombe) 		PF10383
(Clr2)
PF16761
(Clr2_transil) 		3 VAL A 172
GLN A  46
CYH A  48
 None
 0.57A 5icxA-5ikjA:
undetectable
5icxE-5ikjA:
undetectable		 5icxA-5ikjA:
19.43
5icxE-5ikjA:
2.67
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.
5iz4 PUTATIVE SHORT-CHAIN
DEHYDROGENASE/REDUCT
ASE

(Paraburkholderia
xenovorans) 		PF13561
(adh_short_C2) 		3 VAL A  33
GLN A  28
CYH A  53
 None
 0.81A 5icxA-5iz4A:
undetectable
5icxE-5iz4A:
undetectable		 5icxA-5iz4A:
21.05
5icxE-5iz4A:
7.34
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.
5lst ATP-DEPENDENT DNA
HELICASE Q4

(Homo sapiens) 		PF00270
(DEAD)
PF00271
(Helicase_C) 		3 VAL A 846
GLN A1050
CYH A1052
 None
 0.71A 5icxA-5lstA:
undetectable
5icxE-5lstA:
undetectable		 5icxA-5lstA:
14.33
5icxE-5lstA:
3.57
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.
5msy GLYCOSIDE HYDROLASE

(Bacteroides
thetaiotaomicron) 		PF12904
(Collagen_bind_2)
PF13204
(DUF4038) 		3 VAL A 472
GLN A 478
CYH A 476
 None
 0.81A 5icxA-5msyA:
undetectable
5icxE-5msyA:
undetectable		 5icxA-5msyA:
18.70
5icxE-5msyA:
2.45
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.
5nth PUTATIVE
AMINOPEPTIDASE

(Leishmania
major) 		PF00883
(Peptidase_M17) 		3 VAL A 529
GLN A 215
CYH A 217
 None
 0.70A 5icxA-5nthA:
undetectable
5icxE-5nthA:
undetectable		 5icxA-5nthA:
17.16
5icxE-5nthA:
3.02
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.
5tuv TRANSCRIPTION FACTOR
DP1
TRANSCRIPTION FACTOR
E2F5

(Homo sapiens) 		PF08781
(DP)
PF16421
(E2F_CC-MB) 		3 VAL B 126
GLN A 200
CYH A 202
 None
 0.75A 5icxA-5tuvB:
undetectable
5icxE-5tuvB:
undetectable		 5icxA-5tuvB:
20.19
5icxE-5tuvB:
7.69
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.
5u24 PUTATIVE
AMINOTRANSFERASE

(Campylobacter
jejuni) 		PF01041
(DegT_DnrJ_EryC1) 		3 VAL A 169
GLN A 158
CYH A 156
 None
7SG  A 402 (-3.7A)
None
 0.84A 5icxA-5u24A:
undetectable
5icxE-5u24A:
undetectable		 5icxA-5u24A:
20.48
5icxE-5u24A:
4.20
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.
5uag DNA-DIRECTED RNA
POLYMERASE SUBUNIT
ALPHA

(Escherichia
coli) 		PF01000
(RNA_pol_A_bac)
PF01193
(RNA_pol_L) 		3 VAL A  92
GLN A 147
CYH A  54
 None
 0.70A 5icxA-5uagA:
3.5
5icxE-5uagA:
undetectable		 5icxA-5uagA:
20.51
5icxE-5uagA:
4.70
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.
5uqi PHOSPHOSUGAR
ISOMERASE

(Escherichia
coli) 		no annotation 3 VAL A  46
GLN A  40
CYH A  42
 None
 0.68A 5icxA-5uqiA:
undetectable
5icxE-5uqiA:
undetectable		 5icxA-5uqiA:
16.20
5icxE-5uqiA:
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.
5uwz ALDEHYDE
DECARBONYLASE

(Gloeobacter
violaceus) 		no annotation 3 VAL A 137
GLN A  69
CYH A  71
 None
None
STE  A 303 ( 4.4A)
 0.57A 5icxA-5uwzA:
undetectable
5icxE-5uwzA:
undetectable		 5icxA-5uwzA:
15.87
5icxE-5uwzA:
7.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5w81 CYSTIC FIBROSIS
TRANSMEMBRANE
CONDUCTANCE
REGULATOR

(Danio rerio) 		PF00005
(ABC_tran)
PF00664
(ABC_membrane)
PF14396
(CFTR_R) 		3 VAL A1009
GLN A1152
CYH A1154
 None
 0.78A 5icxA-5w81A:
undetectable
5icxE-5w81A:
undetectable		 5icxA-5w81A:
9.23
5icxE-5w81A:
1.02
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.
5xuo POLYKETIDE SYNTHASE
PKS13

(Mycobacterium
tuberculosis) 		no annotation 3 VAL A 748
GLN A 773
CYH A 824
 None
 0.81A 5icxA-5xuoA:
undetectable
5icxE-5xuoA:
undetectable		 5icxA-5xuoA:
13.02
5icxE-5xuoA:
9.09
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.
5xzx IMPORTIN SUBUNIT
ALPHA-3

(Homo sapiens) 		PF00514
(Arm)
PF16186
(Arm_3) 		3 VAL A  92
GLN A 132
CYH A 122
 None
 0.79A 5icxA-5xzxA:
undetectable
5icxE-5xzxA:
undetectable		 5icxA-5xzxA:
18.95
5icxE-5xzxA:
2.96
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.
6fcx METHYLENETETRAHYDROF
OLATE REDUCTASE

(Homo sapiens) 		no annotation 3 VAL A 536
GLN A 634
CYH A 631
 None
 0.81A 5icxA-6fcxA:
1.9
5icxE-6fcxA:
undetectable		 5icxA-6fcxA:
16.90
5icxE-6fcxA:
11.59