SIMILAR PATTERNS OF AMINO ACIDS FOR 6CNK_B_NCTB402_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.
1c39 CATION-DEPENDENT
MANNOSE-6-PHOSPHATE
RECEPTOR

(Bos taurus) 		PF02157
(Man-6-P_recep) 		4 CSS A   6
CSS A  52
TYR A  96
LEU A   8
 None
 1.29A 6cnkB-1c39A:
undetectable
6cnkC-1c39A:
undetectable		 6cnkB-1c39A:
19.87
6cnkC-1c39A:
21.17
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.
1gcy GLUCAN
1,4-ALPHA-MALTOTETRA
HYDROLASE

(Pseudomonas
stutzeri) 		PF00128
(Alpha-amylase)
PF09081
(DUF1921) 		4 TYR A 198
TRP A 206
CSS A 251
CSS A 216
 None
 1.44A 6cnkB-1gcyA:
undetectable
6cnkC-1gcyA:
undetectable		 6cnkB-1gcyA:
10.75
6cnkC-1gcyA:
10.65
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.
1poi GLUTACONATE COENZYME
A-TRANSFERASE

(Acidaminococcus
fermentans) 		PF01144
(CoA_trans) 		4 TYR A  33
CYH A 279
TYR A 265
LEU A  40
 None
 1.16A 6cnkB-1poiA:
undetectable
6cnkC-1poiA:
undetectable		 6cnkB-1poiA:
11.64
6cnkC-1poiA:
13.31
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.
2bg9 ACETYLCHOLINE
RECEPTOR PROTEIN,
GAMMA CHAIN

(Torpedo
marmorata) 		PF02931
(Neur_chan_LBD)
PF02932
(Neur_chan_memb) 		4 TRP E 183
CSS E 141
TYR E 133
LEU E  39
 None
 1.14A 6cnkB-2bg9E:
19.0
6cnkC-2bg9E:
17.1		 6cnkB-2bg9E:
11.62
6cnkC-2bg9E:
11.40
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.
2bj0 ACETYLCHOLINE-BINDIN
G PROTEIN

(Bulinus
truncatus) 		PF02931
(Neur_chan_LBD) 		5 TYR A  88
TRP A 142
CSS A 186
CSS A 187
TYR A 191
 None
CXS  A1204 (-3.6A)
CXS  A1204 (-3.4A)
CXS  A1204 (-3.6A)
CXS  A1204 (-4.7A)
 0.68A 6cnkB-2bj0A:
15.1
6cnkC-2bj0A:
20.7		 6cnkB-2bj0A:
17.44
6cnkC-2bj0A:
15.08
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.
2bj0 ACETYLCHOLINE-BINDIN
G PROTEIN

(Bulinus
truncatus) 		PF02931
(Neur_chan_LBD) 		4 TYR A  88
TRP A 142
CSS A 187
TYR A 191
 None
CXS  A1204 (-3.6A)
CXS  A1204 (-3.6A)
CXS  A1204 (-4.7A)
 1.28A 6cnkB-2bj0A:
15.1
6cnkC-2bj0A:
20.7		 6cnkB-2bj0A:
17.44
6cnkC-2bj0A:
15.08
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.
2c11 MEMBRANE COPPER
AMINE OXIDASE

(Homo sapiens) 		PF01179
(Cu_amine_oxid)
PF02727
(Cu_amine_oxidN2)
PF02728
(Cu_amine_oxidN3) 		4 CSS A 199
CSS A 198
TYR A 266
LEU A 208
 None
 1.06A 6cnkB-2c11A:
undetectable
6cnkC-2c11A:
undetectable		 6cnkB-2c11A:
8.35
6cnkC-2c11A:
8.37
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.
2eql HORSE MILK LYSOZYME

(Equus caballus) 		PF00062
(Lys) 		4 CSS A  94
CSS A  76
TRP A 108
LEU A  59
 None
 1.33A 6cnkB-2eqlA:
undetectable
6cnkC-2eqlA:
undetectable		 6cnkB-2eqlA:
20.77
6cnkC-2eqlA:
16.28
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.
2l2g IGF2R DOMAIN 11

(Monodelphis
domestica) 		PF00878
(CIMR) 		4 TYR A1554
CSS A1532
TRP A1656
LEU A1660
 None
 1.27A 6cnkB-2l2gA:
undetectable
6cnkC-2l2gA:
undetectable		 6cnkB-2l2gA:
22.38
6cnkC-2l2gA:
18.06
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ppq HOMOSERINE KINASE

(Agrobacterium
fabrum) 		PF01636
(APH) 		4 TYR A 222
TRP A 148
TRP A 181
LEU A 177
 None
 1.32A 6cnkB-2ppqA:
undetectable
6cnkC-2ppqA:
undetectable		 6cnkB-2ppqA:
14.33
6cnkC-2ppqA:
13.23
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.
3alx HEMAGGLUTININ,LINKER
,CDW150

(Measles
morbillivirus;
Saguinus
oedipus;
synthetic
construct) 		PF00423
(HN)
PF06214
(SLAM) 		4 TYR A 551
CSS A 570
TYR A 540
LEU A 517
 None
 1.43A 6cnkB-3alxA:
undetectable
6cnkC-3alxA:
undetectable		 6cnkB-3alxA:
9.69
6cnkC-3alxA:
8.92
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.
3fg6 ADSEVERIN

(Homo sapiens) 		PF00626
(Gelsolin) 		4 TYR A 425
TYR A 494
TRP A 440
LEU A 491
 None
 1.27A 6cnkB-3fg6A:
undetectable
6cnkC-3fg6A:
undetectable		 6cnkB-3fg6A:
12.50
6cnkC-3fg6A:
13.51
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.
3nbu GLUCOSE-6-PHOSPHATE
ISOMERASE

(Escherichia
coli) 		PF00342
(PGI) 		4 TYR A 370
TRP A  12
CYH A  73
LEU A  69
 None
 1.30A 6cnkB-3nbuA:
undetectable
6cnkC-3nbuA:
undetectable		 6cnkB-3nbuA:
11.95
6cnkC-3nbuA:
9.26
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.
3qom 6-PHOSPHO-BETA-GLUCO
SIDASE

(Lactobacillus
plantarum) 		PF00232
(Glyco_hydro_1) 		4 TYR A 157
TRP A  94
TRP A 148
LEU A 141
 None
 1.40A 6cnkB-3qomA:
undetectable
6cnkC-3qomA:
undetectable		 6cnkB-3qomA:
9.36
6cnkC-3qomA:
11.54
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.
3qv2 5-CYTOSINE DNA
METHYLTRANSFERASE

(Entamoeba
histolytica) 		PF00145
(DNA_methylase) 		4 TYR A 107
TRP A  75
TYR A 147
LEU A 114
 None
 1.36A 6cnkB-3qv2A:
undetectable
6cnkC-3qv2A:
undetectable		 6cnkB-3qv2A:
12.69
6cnkC-3qv2A:
13.06
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3zdh ACETYLCHOLINE
BINDING PROTEIN

(Lymnaea
stagnalis) 		PF02931
(Neur_chan_LBD) 		5 TYR A  89
TRP A 143
CSS A 187
CSS A 188
TYR A 192
 None
XRS  A 301 (-3.6A)
XRS  A 301 ( 3.8A)
XRS  A 301 ( 3.7A)
XRS  A 301 (-3.8A)
 0.47A 6cnkB-3zdhA:
14.2
6cnkC-3zdhA:
20.7		 6cnkB-3zdhA:
19.17
6cnkC-3zdhA:
17.56
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.
4aod ACETYLCHOLINE-BINDIN
G PROTEIN TYPE 1

(Biomphalaria
glabrata) 		PF02931
(Neur_chan_LBD) 		4 TRP A 146
CSS A 188
CSS A 189
TYR A 193
 None
 0.46A 6cnkB-4aodA:
15.2
6cnkC-4aodA:
20.7		 6cnkB-4aodA:
18.04
6cnkC-4aodA:
16.83
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.
4aoe ACETYLCHOLINE-BINDIN
G PROTEIN TYPE 2

(Biomphalaria
glabrata) 		PF02931
(Neur_chan_LBD) 		4 TYR A  92
TRP A 146
CSS A 188
CSS A 189
 None
 0.58A 6cnkB-4aoeA:
15.1
6cnkC-4aoeA:
20.7		 6cnkB-4aoeA:
15.31
6cnkC-4aoeA:
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.
4arr TOLL RECEPTOR,
VARIABLE LYMPHOCYTE
RECEPTOR B.61
CHIMERA

(Drosophila
melanogaster;
Eptatretus
burgeri) 		PF11921
(DUF3439)
PF13855
(LRR_8) 		4 TYR A 121
CSS A  56
CSS A  43
LEU A  67
 None
 1.41A 6cnkB-4arrA:
undetectable
6cnkC-4arrA:
undetectable		 6cnkB-4arrA:
15.33
6cnkC-4arrA:
17.78
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.
4b5d CAPITELLA TELETA
ACHBP

(Capitella
teleta) 		PF02931
(Neur_chan_LBD) 		4 TRP A 153
CSS A 196
CSS A 197
TYR A 201
 SW4  A1213 (-4.0A)
SW4  A1213 ( 4.2A)
SW4  A1213 (-3.6A)
SW4  A1213 (-3.7A)
 0.74A 6cnkB-4b5dA:
17.6
6cnkC-4b5dA:
21.2		 6cnkB-4b5dA:
13.59
6cnkC-4b5dA:
19.26
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.
4bv4 PROTEIN TOLL,
VARIABLE LYMPHOCYTE
RECEPTOR B CHIMERA

(Drosophila
melanogaster;
Eptatretus
burgeri) 		PF11921
(DUF3439)
PF13855
(LRR_8) 		4 TYR R 121
CSS R  56
CSS R  43
LEU R  67
 None
 1.34A 6cnkB-4bv4R:
undetectable
6cnkC-4bv4R:
undetectable		 6cnkB-4bv4R:
9.71
6cnkC-4bv4R:
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.
4c90 ALPHA-GLUCURONIDASE
GH115

(Bacteroides
ovatus) 		PF15979
(Glyco_hydro_115) 		4 TYR A 219
TYR A 229
TRP A 214
LEU A 211
 None
 1.29A 6cnkB-4c90A:
4.8
6cnkC-4c90A:
5.3		 6cnkB-4c90A:
6.01
6cnkC-4c90A:
7.92
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.
4cg1 CUTINASE

(Thermobifida
fusca) 		PF12740
(Chlorophyllase2) 		4 TYR A 189
CSS A 259
CSS A 241
TYR A 255
 None
 1.29A 6cnkB-4cg1A:
undetectable
6cnkC-4cg1A:
undetectable		 6cnkB-4cg1A:
12.27
6cnkC-4cg1A:
16.41
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.
4jwh TRNA
(GUANINE(9)-N1)-METH
YLTRANSFERASE

(Schizosaccharomyces
pombe) 		PF01746
(tRNA_m1G_MT) 		4 TYR A 162
CYH A 116
TRP A 159
LEU A 152
 None
 1.35A 6cnkB-4jwhA:
undetectable
6cnkC-4jwhA:
undetectable		 6cnkB-4jwhA:
14.61
6cnkC-4jwhA:
15.46
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.
4lxr PROTEIN TOLL

(Drosophila
melanogaster) 		PF00560
(LRR_1)
PF01462
(LRRNT)
PF13306
(LRR_5)
PF13855
(LRR_8) 		4 TYR A 121
CSS A  56
CSS A  43
LEU A  67
 None
 1.22A 6cnkB-4lxrA:
undetectable
6cnkC-4lxrA:
undetectable		 6cnkB-4lxrA:
8.12
6cnkC-4lxrA:
8.56
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.
4mqt MUSCARINIC
ACETYLCHOLINE
RECEPTOR M2

(Homo sapiens) 		PF00001
(7tm_1) 		4 TYR A 430
TYR A 403
TRP A  99
LEU A 100
 IXO  A 501 (-4.5A)
IXO  A 501 (-3.8A)
None
None
 1.49A 6cnkB-4mqtA:
undetectable
6cnkC-4mqtA:
undetectable		 6cnkB-4mqtA:
12.46
6cnkC-4mqtA:
11.75
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.
4p6v NA(+)-TRANSLOCATING
NADH-QUINONE
REDUCTASE SUBUNIT F

(Vibrio cholerae) 		PF00111
(Fer2)
PF00175
(NAD_binding_1)
PF00970
(FAD_binding_6) 		4 TYR F 212
CYH F 258
TYR F 248
LEU F 152
 FAD  F 502 (-3.8A)
None
None
None
 1.46A 6cnkB-4p6vF:
undetectable
6cnkC-4p6vF:
undetectable		 6cnkB-4p6vF:
11.23
6cnkC-4p6vF:
10.61
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.
4uy9 MITOGEN-ACTIVATED
PROTEIN KINASE
KINASE KINASE 9

(Homo sapiens) 		PF00069
(Pkinase) 		4 CYH A 210
CYH A 217
TRP A 163
LEU A 144
 None
 1.48A 6cnkB-4uy9A:
undetectable
6cnkC-4uy9A:
undetectable		 6cnkB-4uy9A:
13.44
6cnkC-4uy9A:
14.84
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.
4zg7 ECTONUCLEOTIDE
PYROPHOSPHATASE/PHOS
PHODIESTERASE FAMILY
MEMBER 2

(Homo sapiens) 		PF01033
(Somatomedin_B)
PF01223
(Endonuclease_NS)
PF01663
(Phosphodiest) 		4 TYR A 215
CYH A 514
TYR A 510
TRP A 261
 4O0  A 908 (-4.3A)
None
None
4O0  A 908 (-4.4A)
 1.50A 6cnkB-4zg7A:
undetectable
6cnkC-4zg7A:
undetectable		 6cnkB-4zg7A:
6.95
6cnkC-4zg7A:
8.16
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.
4ztp HEAVY CHAIN OF FAB
FRAGMENT OF RABBIT
MONOCLONAL ANTIBODY
R53
LIGHT CHAIN OF FAB
FRAGMENT OF RABBIT
MONOCLONAL ANTIBODY
R53

(Oryctolagus
cuniculus) 		PF07654
(C1-set)
PF07686
(V-set) 		4 TYR L  36
CSS H  34
CSS H  49
TRP H 102
 None
 1.09A 6cnkB-4ztpL:
undetectable
6cnkC-4ztpL:
undetectable		 6cnkB-4ztpL:
15.74
6cnkC-4ztpL:
17.35
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.
5ah0 LIPASE

(Pelosinus
fermentans) 		no annotation 4 TYR A 213
CYH A 376
TYR A  40
LEU A 292
 None
 1.45A 6cnkB-5ah0A:
undetectable
6cnkC-5ah0A:
undetectable		 6cnkB-5ah0A:
12.87
6cnkC-5ah0A:
11.97
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.
5by6 THYMIDYLATE SYNTHASE

(Trichinella
spiralis) 		PF00303
(Thymidylat_synt) 		4 TYR A 224
TRP A 133
CYH A 158
LEU A 155
 None
 1.16A 6cnkB-5by6A:
undetectable
6cnkC-5by6A:
undetectable		 6cnkB-5by6A:
13.27
6cnkC-5by6A:
15.03
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.
5c6g AGR133CP
SISTER CHROMATID
COHESION PROTEIN 2

(Eremothecium
gossypii) 		PF10345
(Cohesin_load)
no annotation 		4 CYH B 112
TYR A  55
TRP B  61
LEU A  47
 None
 1.46A 6cnkB-5c6gB:
undetectable
6cnkC-5c6gB:
undetectable		 6cnkB-5c6gB:
18.81
6cnkC-5c6gB:
17.13
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5fjv NEURONAL
ACETYLCHOLINE
RECEPTOR SUBUNIT
ALPHA-2

(Homo sapiens) 		PF02931
(Neur_chan_LBD) 		4 TYR A 122
TRP A 178
CSS A 221
CSS A 222
 EPJ  A 300 (-4.6A)
EPJ  A 300 (-3.7A)
EPJ  A 300 ( 4.2A)
EPJ  A 300 ( 4.2A)
 0.78A 6cnkB-5fjvA:
16.9
6cnkC-5fjvA:
23.9		 6cnkB-5fjvA:
59.38
6cnkC-5fjvA:
21.78
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5fjv NEURONAL
ACETYLCHOLINE
RECEPTOR SUBUNIT
ALPHA-2

(Homo sapiens) 		PF02931
(Neur_chan_LBD) 		4 TYR A 122
TRP A 178
CSS A 222
TYR A 226
 EPJ  A 300 (-4.6A)
EPJ  A 300 (-3.7A)
EPJ  A 300 ( 4.2A)
EPJ  A 300 (-3.7A)
 0.84A 6cnkB-5fjvA:
16.9
6cnkC-5fjvA:
23.9		 6cnkB-5fjvA:
59.38
6cnkC-5fjvA:
21.78
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5fjv NEURONAL
ACETYLCHOLINE
RECEPTOR SUBUNIT
ALPHA-2

(Homo sapiens) 		PF02931
(Neur_chan_LBD) 		4 TYR A 122
TRP A 178
CSS A 222
TYR A 226
 EPJ  A 300 (-4.6A)
EPJ  A 300 (-3.7A)
EPJ  A 300 ( 4.2A)
EPJ  A 300 (-3.7A)
 0.97A 6cnkB-5fjvA:
16.9
6cnkC-5fjvA:
23.9		 6cnkB-5fjvA:
59.38
6cnkC-5fjvA:
21.78
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5kxi NEURONAL
ACETYLCHOLINE
RECEPTOR SUBUNIT
ALPHA-4

(Homo sapiens) 		PF02931
(Neur_chan_LBD)
PF02932
(Neur_chan_memb) 		5 TYR A 100
TRP A 156
CSS A 199
CSS A 200
TYR A 204
 NCT  A 402 (-4.8A)
NCT  A 402 (-3.9A)
NCT  A 402 (-3.5A)
NCT  A 402 (-3.6A)
NCT  A 402 (-3.8A)
 0.80A 6cnkB-5kxiA:
36.6
6cnkC-5kxiA:
18.6		 6cnkB-5kxiA:
100.00
6cnkC-5kxiA:
12.96
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5kxi NEURONAL
ACETYLCHOLINE
RECEPTOR SUBUNIT
ALPHA-4

(Homo sapiens) 		PF02931
(Neur_chan_LBD)
PF02932
(Neur_chan_memb) 		4 TYR A 100
TRP A 156
CSS A 200
TYR A 204
 NCT  A 402 (-4.8A)
NCT  A 402 (-3.9A)
NCT  A 402 (-3.6A)
NCT  A 402 (-3.8A)
 0.89A 6cnkB-5kxiA:
36.6
6cnkC-5kxiA:
18.6		 6cnkB-5kxiA:
100.00
6cnkC-5kxiA:
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.
5m63 H CHAIN OF FAB
NVS-1-19-5
L CHAIN OF FAB
NVS-1-19-5

(Oryctolagus
cuniculus) 		PF07654
(C1-set)
PF07686
(V-set) 		4 TYR L  60
CSS H  53
CSS H  68
TRP H 134
 None
 1.05A 6cnkB-5m63L:
2.4
6cnkC-5m63L:
undetectable		 6cnkB-5m63L:
15.29
6cnkC-5m63L:
16.22
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.
5m6q UNCHARACTERIZED
PROTEIN

(Kutzneria
albida) 		PF09017
(Transglut_prok) 		4 TYR A  22
TRP A 187
TYR A  29
TRP A  17
 None
None
None
PG4  A 305 ( 4.2A)
 1.18A 6cnkB-5m6qA:
undetectable
6cnkC-5m6qA:
undetectable		 6cnkB-5m6qA:
15.56
6cnkC-5m6qA:
18.96
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.
5mqp GLYCOSIDE HYDROLASE
BT_1002

(Bacteroides
thetaiotaomicron) 		no annotation 4 TRP A 497
CYH A 202
TRP A 495
LEU A 335
 None
 1.45A 6cnkB-5mqpA:
undetectable
6cnkC-5mqpA:
undetectable		 6cnkB-5mqpA:
12.66
6cnkC-5mqpA:
9.04
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.
5xyi GUANINE
NUCLEOTIDE-BINDING
PROTEIN BETA
SUBUNIT, PUTATIVE

(Trichomonas
vaginalis) 		no annotation 4 TYR g 322
TRP g 330
CYH g 267
LEU g 318
 None
 1.31A 6cnkB-5xyig:
undetectable
6cnkC-5xyig:
undetectable		 6cnkB-5xyig:
15.36
6cnkC-5xyig:
10.75
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.
6bzc GLUCOSE-6-PHOSPHATE
ISOMERASE

(Elizabethkingia
anophelis) 		no annotation 4 TYR A 369
TRP A  14
CYH A  73
LEU A  69
 None
 1.27A 6cnkB-6bzcA:
undetectable
6cnkC-6bzcA:
undetectable		 6cnkB-6bzcA:
24.75
6cnkC-6bzcA:
15.66
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6cjk

() 		no annotation 4 TYR A  36
CSS B  35
CSS B  50
TRP B 103
 None
 1.05A 6cnkB-6cjkA:
undetectable
6cnkC-6cjkA:
undetectable		 6cnkB-6cjkA:
undetectable
6cnkC-6cjkA:
undetectable