SIMILAR PATTERNS OF AMINO ACIDS FOR 5ADE_A_H4BA760_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.
1a6c TOBACCO RINGSPOT
VIRUS CAPSID PROTEIN

(Tobacco
ringspot virus) 		PF03391
(Nepo_coat)
PF03688
(Nepo_coat_C)
PF03689
(Nepo_coat_N) 		4 VAL A 496
ARG A 482
VAL A 390
PHE A 374
 None
 1.31A 5adeA-1a6cA:
0.0
5adeB-1a6cA:
0.0		 5adeA-1a6cA:
20.38
5adeB-1a6cA:
20.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1b41 ACETYLCHOLINESTERASE

(Homo sapiens) 		PF00135
(COesterase) 		4 VAL A 326
ARG A 219
VAL A 209
PHE A 222
 None
 1.17A 5adeA-1b41A:
0.0
5adeB-1b41A:
0.0		 5adeA-1b41A:
20.61
5adeB-1b41A:
20.61
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.
1c2o ACETYLCHOLINESTERASE

(Electrophorus
electricus) 		PF00135
(COesterase) 		4 VAL A 326
ARG A 219
VAL A 209
PHE A 222
 None
 1.06A 5adeA-1c2oA:
0.0
5adeB-1c2oA:
0.0		 5adeA-1c2oA:
20.04
5adeB-1c2oA:
20.04
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.
1em8 DNA POLYMERASE III
CHI SUBUNIT

(Escherichia
coli) 		PF04364
(DNA_pol3_chi) 		4 VAL A  21
ARG A 130
VAL A 114
PHE A   6
 None
 1.32A 5adeA-1em8A:
0.0
5adeB-1em8A:
0.0		 5adeA-1em8A:
18.05
5adeB-1em8A:
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.
1g5i MITOCHONDRIAL DNA
POLYMERASE ACCESSORY
SUBUNIT

(Mus musculus) 		PF03129
(HGTP_anticodon) 		4 VAL A 187
ARG A  72
VAL A 316
PHE A  73
 None
 1.44A 5adeA-1g5iA:
0.0
5adeB-1g5iA:
0.0		 5adeA-1g5iA:
22.18
5adeB-1g5iA:
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.
1gqj ALPHA-D-GLUCURONIDAS
E

(Cellvibrio
japonicus) 		PF03648
(Glyco_hydro_67N)
PF07477
(Glyco_hydro_67C)
PF07488
(Glyco_hydro_67M) 		4 VAL A 444
VAL A 210
TRP A 160
PHE A 327
 None
 1.46A 5adeA-1gqjA:
0.0
5adeB-1gqjA:
0.0		 5adeA-1gqjA:
19.56
5adeB-1gqjA:
19.56
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.
1mqq ALPHA-D-GLUCURONIDAS
E

(Geobacillus
stearothermophilus) 		PF03648
(Glyco_hydro_67N)
PF07477
(Glyco_hydro_67C)
PF07488
(Glyco_hydro_67M) 		4 VAL A 443
VAL A 200
TRP A 150
PHE A 320
 None
None
GCU  A 701 (-4.7A)
GCU  A 701 (-3.8A)
 1.49A 5adeA-1mqqA:
0.0
5adeB-1mqqA:
0.0		 5adeA-1mqqA:
22.03
5adeB-1mqqA:
22.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1odo PUTATIVE CYTOCHROME
P450 154A1

(Streptomyces
coelicolor) 		PF00067
(p450) 		4 VAL A 279
VAL A 268
TRP A 275
PHE A 372
 None
 1.46A 5adeA-1odoA:
0.0
5adeB-1odoA:
0.0		 5adeA-1odoA:
20.70
5adeB-1odoA:
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.
1rzg FAB 412D LIGHT CHAIN

(Homo sapiens) 		PF07654
(C1-set)
PF07686
(V-set) 		4 VAL A 111
ARG A  38
VAL A  18
PHE A  90
 None
SUC  A9002 (-4.2A)
None
None
 1.32A 5adeA-1rzgA:
0.0
5adeB-1rzgA:
0.0		 5adeA-1rzgA:
18.46
5adeB-1rzgA:
18.46
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.
1t1j HYPOTHETICAL PROTEIN

(Pseudomonas
aeruginosa) 		PF09152
(DUF1937) 		4 ARG A   2
VAL A  28
TRP A 110
PHE A 117
 None
 1.45A 5adeA-1t1jA:
undetectable
5adeB-1t1jA:
undetectable		 5adeA-1t1jA:
16.38
5adeB-1t1jA:
16.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1xn6 HYPOTHETICAL PROTEIN
BC4709

(Bacillus cereus) 		PF08327
(AHSA1) 		4 VAL A  27
VAL A 140
TRP A  36
PHE A  16
 None
 1.06A 5adeA-1xn6A:
undetectable
5adeB-1xn6A:
undetectable		 5adeA-1xn6A:
15.33
5adeB-1xn6A:
15.33
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.
2ht6 GTP-BINDING PROTEIN
GEM

(Homo sapiens) 		PF00071
(Ras) 		4 VAL A 236
ARG A 116
VAL A  78
PHE A  95
 None
 1.49A 5adeA-2ht6A:
undetectable
5adeB-2ht6A:
undetectable		 5adeA-2ht6A:
18.25
5adeB-2ht6A:
18.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2i3y EPIDIDYMAL SECRETORY
GLUTATHIONE
PEROXIDASE

(Homo sapiens) 		PF00255
(GSHPx) 		4 VAL A 140
ARG A 197
VAL A 148
PHE A 186
 None
 1.45A 5adeA-2i3yA:
undetectable
5adeB-2i3yA:
undetectable		 5adeA-2i3yA:
20.14
5adeB-2i3yA:
20.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2i9y MAJOR LATEX
PROTEIN-LIKE PROTEIN
28 OR MLP-LIKE
PROTEIN 28

(Arabidopsis
thaliana) 		PF00407
(Bet_v_1) 		4 VAL A 161
VAL A 135
TRP A 137
PHE A  39
 None
 1.41A 5adeA-2i9yA:
undetectable
5adeB-2i9yA:
undetectable		 5adeA-2i9yA:
21.05
5adeB-2i9yA:
21.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2nxf PUTATIVE DIMETAL
PHOSPHATASE

(Danio rerio) 		PF00149
(Metallophos) 		4 VAL A  52
ARG A 311
VAL A  44
PHE A 296
 EOH  A 502 (-4.7A)
None
None
None
 1.22A 5adeA-2nxfA:
undetectable
5adeB-2nxfA:
undetectable		 5adeA-2nxfA:
22.59
5adeB-2nxfA:
22.59
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.
2ot9 HYPOTHETICAL PROTEIN

(Pseudomonas
syringae group
genomosp. 3) 		PF07152
(YaeQ) 		4 VAL A 152
ARG A 179
VAL A 170
PHE A  49
 None
 1.21A 5adeA-2ot9A:
undetectable
5adeB-2ot9A:
undetectable		 5adeA-2ot9A:
19.07
5adeB-2ot9A:
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.
2w4o CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE TYPE IV

(Homo sapiens) 		PF00069
(Pkinase) 		4 ARG A 278
VAL A 269
TRP A 266
PHE A 261
 None
 1.47A 5adeA-2w4oA:
undetectable
5adeB-2w4oA:
undetectable		 5adeA-2w4oA:
20.26
5adeB-2w4oA:
20.26
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.
2wfx HEDGEHOG-INTERACTING
PROTEIN

(Homo sapiens) 		PF07995
(GSDH) 		4 VAL B 334
ARG B 241
VAL B 251
PHE B 243
 None
 1.43A 5adeA-2wfxB:
undetectable
5adeB-2wfxB:
undetectable		 5adeA-2wfxB:
22.92
5adeB-2wfxB:
22.92
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.
2zbv UNCHARACTERIZED
CONSERVED PROTEIN

(Thermotoga
maritima) 		PF01887
(SAM_adeno_trans) 		4 VAL A  71
ARG A 129
VAL A  66
TRP A   8
 ADN  A 501 ( 4.5A)
None
ADN  A 501 (-4.9A)
ADN  A 501 (-4.6A)
 1.44A 5adeA-2zbvA:
undetectable
5adeB-2zbvA:
undetectable		 5adeA-2zbvA:
21.51
5adeB-2zbvA:
21.51
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.
3bit FACT COMPLEX SUBUNIT
SPT16

(Saccharomyces
cerevisiae) 		PF00557
(Peptidase_M24)
PF14826
(FACT-Spt16_Nlob) 		4 ARG A 105
VAL A  35
TRP A 147
PHE A 117
 None
 1.50A 5adeA-3bitA:
undetectable
5adeB-3bitA:
undetectable		 5adeA-3bitA:
23.92
5adeB-3bitA:
23.92
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.
3ce6 ADENOSYLHOMOCYSTEINA
SE

(Mycobacterium
tuberculosis) 		PF00670
(AdoHcyase_NAD)
PF05221
(AdoHcyase) 		4 VAL A  15
ARG A  89
VAL A 107
PHE A 123
 None
 1.42A 5adeA-3ce6A:
undetectable
5adeB-3ce6A:
undetectable		 5adeA-3ce6A:
20.78
5adeB-3ce6A:
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.
3cmi PEROXIREDOXIN HYR1

(Saccharomyces
cerevisiae) 		PF00255
(GSHPx) 		4 VAL A  98
ARG A 141
VAL A 106
PHE A 130
 None
 1.40A 5adeA-3cmiA:
undetectable
5adeB-3cmiA:
undetectable		 5adeA-3cmiA:
19.09
5adeB-3cmiA:
19.09
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.
3dxq CHOLINE/ETHANOLAMINE
KINASE FAMILY
PROTEIN

(Mesorhizobium
loti) 		PF01633
(Choline_kinase) 		4 VAL A  69
VAL A 194
TRP A 196
PHE A 184
 None
 1.43A 5adeA-3dxqA:
undetectable
5adeB-3dxqA:
undetectable		 5adeA-3dxqA:
21.05
5adeB-3dxqA:
21.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3iy4 FRAGMENT OF
NEUTRALIZING
ANTIBODY 15 (HEAVY
CHAIN)

(Mus musculus) 		PF07686
(V-set) 		4 VAL B 221
ARG B 172
VAL B 123
PHE B 173
 None
 1.20A 5adeA-3iy4B:
undetectable
5adeB-3iy4B:
undetectable		 5adeA-3iy4B:
13.03
5adeB-3iy4B:
13.03
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.
3ma6 CALMODULIN-DOMAIN
PROTEIN KINASE 1

(Toxoplasma
gondii) 		PF00069
(Pkinase) 		4 ARG A 269
VAL A 260
TRP A 257
PHE A 252
 None
 1.43A 5adeA-3ma6A:
undetectable
5adeB-3ma6A:
undetectable		 5adeA-3ma6A:
21.78
5adeB-3ma6A:
21.78
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.
3q7p GTP-BINDING PROTEIN
RAD

(Homo sapiens) 		PF00071
(Ras) 		4 VAL A 248
ARG A 129
VAL A  94
PHE A 111
 None
 1.40A 5adeA-3q7pA:
undetectable
5adeB-3q7pA:
undetectable		 5adeA-3q7pA:
16.35
5adeB-3q7pA:
16.35
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.
3qaw RHO-CLASS
GLUTATHIONE
S-TRANSFERASE

(Laternula
elliptica) 		PF00043
(GST_C)
PF13417
(GST_N_3) 		4 VAL A  85
ARG A 199
VAL A  24
PHE A 161
 None
 1.14A 5adeA-3qawA:
undetectable
5adeB-3qawA:
undetectable		 5adeA-3qawA:
20.19
5adeB-3qawA:
20.19
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.
3qh4 ESTERASE LIPW

(Mycobacterium
marinum) 		PF07859
(Abhydrolase_3) 		4 VAL A  71
ARG A  75
VAL A  85
PHE A 151
 None
 1.28A 5adeA-3qh4A:
undetectable
5adeB-3qh4A:
undetectable		 5adeA-3qh4A:
21.60
5adeB-3qh4A:
21.60
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.
3rim TRANSKETOLASE

(Mycobacterium
tuberculosis) 		PF00456
(Transketolase_N)
PF02779
(Transket_pyr)
PF02780
(Transketolase_C) 		4 VAL A 521
ARG A 458
VAL A 488
TRP A 533
 None
 1.35A 5adeA-3rimA:
undetectable
5adeB-3rimA:
undetectable		 5adeA-3rimA:
19.97
5adeB-3rimA:
19.97
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.
3t2n ANTIBODY, FAB
FRAGMENT, LIGHT
CHAIN

(Homo sapiens) 		PF07654
(C1-set)
PF07686
(V-set) 		4 VAL L 106
ARG L  61
VAL L  19
PHE L  62
 None
 1.42A 5adeA-3t2nL:
undetectable
5adeB-3t2nL:
undetectable		 5adeA-3t2nL:
20.15
5adeB-3t2nL:
20.15
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.
3tex PROTECTIVE ANTIGEN

(Bacillus
anthracis) 		PF03495
(Binary_toxB)
PF07691
(PA14)
PF17475
(Binary_toxB_2)
PF17476
(Binary_toxB_3) 		4 VAL A 194
ARG A 242
VAL A  35
PHE A 236
 None
 1.44A 5adeA-3texA:
undetectable
5adeB-3texA:
undetectable		 5adeA-3texA:
20.82
5adeB-3texA:
20.82
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.
4d0m RAS-RELATED PROTEIN
RAB-11A

(Homo sapiens) 		PF00071
(Ras) 		4 VAL B  46
ARG B  82
VAL B  15
TRP B  65
 None
 1.43A 5adeA-4d0mB:
undetectable
5adeB-4d0mB:
undetectable		 5adeA-4d0mB:
21.63
5adeB-4d0mB:
21.63
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4dzr PROTEIN-(GLUTAMINE-N
5)
METHYLTRANSFERASE,
RELEASE
FACTOR-SPECIFIC

(Alicyclobacillus
acidocaldarius) 		PF05175
(MTS) 		4 VAL A 251
ARG A 302
VAL A 259
PHE A 283
 None
 1.40A 5adeA-4dzrA:
undetectable
5adeB-4dzrA:
undetectable		 5adeA-4dzrA:
21.11
5adeB-4dzrA:
21.11
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.
4glt GLUTATHIONE
S-TRANSFERASE-LIKE
PROTEIN

(Methylobacillus
flagellatus) 		PF13410
(GST_C_2)
PF13417
(GST_N_3) 		4 VAL A  76
ARG A 192
VAL A  18
PHE A 152
 None
 1.27A 5adeA-4gltA:
undetectable
5adeB-4gltA:
undetectable		 5adeA-4gltA:
19.07
5adeB-4gltA:
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.
4gt2 PUTATIVE
UNCHARACTERIZED
PROTEIN SCO3963

(Streptomyces
coelicolor) 		no annotation 4 VAL B 289
VAL B 368
TRP B 393
PHE B 268
 None
 1.49A 5adeA-4gt2B:
undetectable
5adeB-4gt2B:
undetectable		 5adeA-4gt2B:
20.77
5adeB-4gt2B:
20.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4hk9 ENDO-1,4-BETA-XYLANA
SE 2

(Trichoderma
reesei) 		PF00457
(Glyco_hydro_11) 		4 VAL A  46
ARG A 122
TRP A  18
TRP A  79
 XYP  A 202 (-4.9A)
XYP  A 203 (-3.7A)
XYP  A 202 (-4.1A)
XYP  A 202 (-4.7A)
 1.49A 5adeA-4hk9A:
undetectable
5adeB-4hk9A:
undetectable		 5adeA-4hk9A:
16.38
5adeB-4hk9A:
16.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4nuj PGT152 HEAVY CHAIN

(Homo sapiens) 		PF07654
(C1-set)
PF07686
(V-set) 		4 VAL B 111
ARG B  66
VAL B  18
PHE B  67
 None
 1.41A 5adeA-4nujB:
undetectable
5adeB-4nujB:
undetectable		 5adeA-4nujB:
21.23
5adeB-4nujB:
21.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4pne METHYLTRANSFERASE-LI
KE PROTEIN

(Saccharopolyspora
spinosa) 		PF08241
(Methyltransf_11) 		4 VAL A 129
ARG A  75
VAL A  79
PHE A 141
 None
 1.31A 5adeA-4pneA:
undetectable
5adeB-4pneA:
undetectable		 5adeA-4pneA:
21.59
5adeB-4pneA:
21.59
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4xj5 CYCLIC AMP-GMP
SYNTHASE

(Vibrio cholerae) 		no annotation 4 ARG A 280
VAL A 309
TRP A 267
PHE A 268
 None
 1.06A 5adeA-4xj5A:
undetectable
5adeB-4xj5A:
undetectable		 5adeA-4xj5A:
20.61
5adeB-4xj5A:
20.61
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.
4yhs MONOSACCHARIDE ABC
TRANSPORTER
SUBSTRATE-BINDING
PROTEIN, CUT2 FAMILY

(Bradyrhizobium
sp. BTAi1) 		PF13407
(Peripla_BP_4) 		4 VAL A 299
VAL A 147
TRP A  72
PHE A  64
 None
 1.32A 5adeA-4yhsA:
undetectable
5adeB-4yhsA:
undetectable		 5adeA-4yhsA:
22.92
5adeB-4yhsA:
22.92
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.
5jse PHIAB6 TAILSPIKE

(unidentified
phage) 		PF12708
(Pectate_lyase_3) 		4 VAL A 341
TRP A 323
TRP A 347
PHE A 290
 None
 1.19A 5adeA-5jseA:
undetectable
5adeB-5jseA:
undetectable		 5adeA-5jseA:
21.55
5adeB-5jseA:
21.55
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.
5jxa VRC03 HEAVY CHAIN

(Homo sapiens) 		PF07654
(C1-set)
PF07686
(V-set) 		4 VAL H 111
ARG H  66
VAL H  18
PHE H  82
 None
 1.37A 5adeA-5jxaH:
undetectable
5adeB-5jxaH:
undetectable		 5adeA-5jxaH:
20.89
5adeB-5jxaH:
20.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5map DTPA

(Streptomyces
lividans) 		PF04261
(Dyp_perox) 		4 VAL A 289
VAL A 368
TRP A 393
PHE A 268
 None
 1.46A 5adeA-5mapA:
undetectable
5adeB-5mapA:
undetectable		 5adeA-5mapA:
21.19
5adeB-5mapA:
21.19
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.
5no8 BACCELL_00875

(Bacteroides
cellulosilyticus) 		no annotation 4 VAL A 538
ARG A 205
TRP A 599
PHE A 606
 None
 1.37A 5adeA-5no8A:
undetectable
5adeB-5no8A:
undetectable		 5adeA-5no8A:
19.21
5adeB-5no8A:
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.
5nst HEAVY CHAIN OF
ANTIBODY MGD21

(Homo sapiens) 		PF07654
(C1-set)
PF07686
(V-set)
PF13895
(Ig_2) 		4 VAL B 204
ARG B 146
VAL B 129
PHE B 183
 None
 1.18A 5adeA-5nstB:
undetectable
5adeB-5nstB:
undetectable		 5adeA-5nstB:
20.54
5adeB-5nstB:
20.54
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.
5nzg UDP-GLUCOSE
PYROPHOSPHORYLASE

(Leishmania
major) 		no annotation 4 VAL A 371
VAL A 231
TRP A 311
PHE A 216
 None
 1.46A 5adeA-5nzgA:
undetectable
5adeB-5nzgA:
undetectable		 5adeA-5nzgA:
11.16
5adeB-5nzgA:
11.16
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.
5twa BAK-2 PROTEIN
BCL-X HOMOLOGOUS
PROTEIN, BHP2

(Geodia
cydonium;
Lubomirskia
baicalensis) 		PF00452
(Bcl-2)
no annotation 		4 VAL D  82
VAL A 136
TRP A 133
PHE A 187
 None
None
B3P  A 309 (-4.3A)
None
 1.47A 5adeA-5twaD:
undetectable
5adeB-5twaD:
undetectable		 5adeA-5twaD:
6.57
5adeB-5twaD:
6.57
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.
5wcd VRC315 04-1D02 FAB
HEAVY CHAIN

(Homo sapiens) 		PF07654
(C1-set)
PF07686
(V-set) 		4 VAL H 122
ARG H  66
VAL H  18
PHE H  67
 None
 1.40A 5adeA-5wcdH:
undetectable
5adeB-5wcdH:
undetectable		 5adeA-5wcdH:
21.43
5adeB-5wcdH:
21.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6b0n PGV19 FAB HEAVY
CHAIN

(Homo sapiens) 		no annotation 4 VAL D 111
ARG D  66
VAL D  18
PHE D  82
 None
 1.30A 5adeA-6b0nD:
undetectable
5adeB-6b0nD:
undetectable		 5adeA-6b0nD:
12.81
5adeB-6b0nD:
12.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6db6 HUMAN MONOCLONAL
ANTI-HIV-1 GP120 V3
ANTIBODY 311-11D FAB
HEAVY CHAIN

(Homo sapiens) 		no annotation 4 VAL H 111
ARG H  38
VAL H  18
PHE H  90
 None
 1.38A 5adeA-6db6H:
undetectable
5adeB-6db6H:
undetectable		 5adeA-6db6H:
12.81
5adeB-6db6H:
12.81