SIMILAR PATTERNS OF AMINO ACIDS FOR 6CHG_C_SAMC1101_0

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.
1gyn FRUCTOSE-BISPHOSPHAT
E ALDOLASE II

(Escherichia
coli) 		PF01116
(F_bP_aldolase) 		5 ILE A 143
SER A 165
PHE A 216
HIS A 141
LEU A 123
 None
 1.36A 6chgC-1gynA:
undetectable		 6chgC-1gynA:
20.37
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.
1jjo NEUROSERPIN
NEUROSERPIN

(Mus musculus;
Mus musculus) 		PF00079
(Serpin)
PF00079
(Serpin) 		5 ILE C 297
SER A  34
HIS A  40
LEU C 299
LEU C 306
 None
 1.17A 6chgC-1jjoC:
undetectable		 6chgC-1jjoC:
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.
1mvh CRYPTIC LOCI
REGULATOR 4

(Schizosaccharomyces
pombe) 		PF00856
(SET)
PF05033
(Pre-SET) 		5 TRP A 340
TYR A 381
PHE A 407
ASN A 409
HIS A 410
 None
 0.76A 6chgC-1mvhA:
6.7		 6chgC-1mvhA:
21.85
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.
1peg HISTONE H3
METHYLTRANSFERASE
DIM-5

(Neurospora
crassa) 		PF00856
(SET)
PF05033
(Pre-SET) 		6 TRP A 161
PHE A 239
ASN A 241
HIS A 242
LEU A 307
LEU A 317
 SAH  A 319 (-4.8A)
None
SAH  A 319 (-3.6A)
SAH  A 319 (-4.3A)
None
SAH  A 319 (-3.9A)
 1.00A 6chgC-1pegA:
9.2		 6chgC-1pegA:
21.52
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.
1peg HISTONE H3
METHYLTRANSFERASE
DIM-5

(Neurospora
crassa) 		PF00856
(SET)
PF05033
(Pre-SET) 		6 TRP A 161
TYR A 204
PHE A 239
ASN A 241
HIS A 242
LEU A 307
 SAH  A 319 (-4.8A)
SAH  A 319 (-4.0A)
None
SAH  A 319 (-3.6A)
SAH  A 319 (-4.3A)
None
 0.64A 6chgC-1pegA:
9.2		 6chgC-1pegA:
21.52
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.
1r1a HUMAN RHINOVIRUS 1A
COAT PROTEIN
(SUBUNIT VP1)
HUMAN RHINOVIRUS 1A
COAT PROTEIN
(SUBUNIT VP3)

(Rhinovirus A;
Rhinovirus A) 		PF00073
(Rhv)
PF00073
(Rhv) 		5 ILE 1 239
TRP 1 173
SER 3  21
PHE 1 179
HIS 1 241
 None
None
None
None
SUC  1 288 (-3.9A)
 1.40A 6chgC-1r1a1:
undetectable		 6chgC-1r1a1:
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.
1tmx HYDROXYQUINOL
1,2-DIOXYGENASE

(Pimelobacter
simplex) 		PF00775
(Dioxygenase_C)
PF04444
(Dioxygenase_N) 		5 ILE A 238
HIS A 237
TYR A 197
LEU A 258
LEU A 246
 None
None
FE  A 861 ( 4.4A)
None
None
 1.08A 6chgC-1tmxA:
undetectable		 6chgC-1tmxA:
19.11
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.
1u1h 5-METHYLTETRAHYDROPT
EROYLTRIGLUTAMATE--H
OMOCYSTEINE
METHYLTRANSFERASE

(Arabidopsis
thaliana) 		PF01717
(Meth_synt_2)
PF08267
(Meth_synt_1) 		5 ILE A 247
SER A 160
PHE A 244
LEU A 255
LEU A 219
 None
 1.39A 6chgC-1u1hA:
undetectable		 6chgC-1u1hA:
10.55
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.
1u7g PROBABLE AMMONIUM
TRANSPORTER

(Escherichia
coli) 		PF00909
(Ammonium_transp) 		5 ILE A  99
HIS A 100
SER A  68
PHE A 107
LEU A  83
 None
None
None
NH4  A 404 (-3.9A)
None
 1.37A 6chgC-1u7gA:
undetectable		 6chgC-1u7gA:
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.
1ua7 ALPHA-AMYLASE

(Bacillus
subtilis) 		PF00128
(Alpha-amylase) 		5 ILE A  11
HIS A  13
SER A  40
LEU A  12
LEU A  22
 None
 1.34A 6chgC-1ua7A:
undetectable		 6chgC-1ua7A:
16.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1uaa PROTEIN
(ATP-DEPENDENT DNA
HELICASE REP.)

(Escherichia
coli) 		PF00580
(UvrD-helicase)
PF13361
(UvrD_C) 		5 ILE A 289
SER A 280
PHE A 303
LEU A 290
LEU A 312
 None
 1.22A 6chgC-1uaaA:
undetectable		 6chgC-1uaaA:
13.60
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.
1uf2 CORE PROTEIN P3

(Rice dwarf
virus) 		PF09231
(RDV-p3) 		5 ILE A 420
ASN A 413
TYR A 476
PHE A 382
LEU A 462
 None
 1.10A 6chgC-1uf2A:
undetectable		 6chgC-1uf2A:
10.79
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.
1w7c LYSYL OXIDASE

(Komagataella
pastoris) 		PF01179
(Cu_amine_oxid)
PF02727
(Cu_amine_oxidN2)
PF09248
(DUF1965) 		5 ILE A  82
TYR A 136
ASN A  93
LEU A  76
LEU A  96
 None
 1.47A 6chgC-1w7cA:
undetectable		 6chgC-1w7cA:
11.46
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.
1xr5 GENOME POLYPROTEIN

(Rhinovirus B) 		PF00680
(RdRP_1) 		5 ILE A 150
SER A 290
TYR A 195
ASN A 186
LEU A 181
 None
 1.37A 6chgC-1xr5A:
undetectable		 6chgC-1xr5A:
18.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1yb6 (S)-ACETONE-CYANOHYD
RIN LYASE

(Hevea
brasiliensis) 		PF00561
(Abhydrolase_1) 		5 ILE A   9
SER A  53
ASN A  85
LEU A  36
LEU A  62
 None
 1.50A 6chgC-1yb6A:
undetectable		 6chgC-1yb6A:
21.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ztm FUSION GLYCOPROTEIN

(Human
respirovirus 3) 		PF00523
(Fusion_gly) 		5 HIS A 206
SER A  52
SER A 275
PHE A 214
LEU A 203
 None
 1.30A 6chgC-1ztmA:
undetectable		 6chgC-1ztmA:
16.78
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.
2c7i PUTATIVE LIPOATE
PROTEIN LIGASE

(Thermoplasma
acidophilum) 		PF03099
(BPL_LplA_LipB) 		5 ILE A 215
SER A 206
ASN A 212
LEU A 214
LEU A 117
 None
 1.38A 6chgC-2c7iA:
undetectable		 6chgC-2c7iA:
20.91
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.
2gy7 ANGIOPOIETIN-2

(Homo sapiens) 		PF00147
(Fibrinogen_C) 		5 ILE A 309
TRP A 354
SER A 350
PHE A 346
LEU A 300
 None
 1.49A 6chgC-2gy7A:
undetectable		 6chgC-2gy7A:
20.28
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.
2ich PUTATIVE ATTH

(Nitrosomonas
europaea) 		PF07143
(CrtC)
PF17186
(Lipocalin_9) 		5 ILE A  68
HIS A  94
SER A 318
SER A 321
PHE A  71
 None
 1.12A 6chgC-2ichA:
undetectable		 6chgC-2ichA:
17.43
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.
2ntj ENOYL-[ACYL-CARRIER-
PROTEIN] REDUCTASE
[NADH

(Mycobacterium
tuberculosis) 		PF13561
(adh_short_C2) 		5 SER A 129
SER A 126
TYR A 125
HIS A  70
LEU A  63
 None
 1.42A 6chgC-2ntjA:
undetectable		 6chgC-2ntjA:
18.18
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.
2poz PUTATIVE DEHYDRATASE

(Mesorhizobium
japonicum) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		5 ILE A 371
SER A  15
ASN A 374
LEU A 347
LEU A  22
 None
 1.19A 6chgC-2pozA:
undetectable		 6chgC-2pozA:
19.74
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.
2r3a HISTONE-LYSINE
N-METHYLTRANSFERASE
SUV39H2

(Homo sapiens) 		PF00856
(SET)
PF05033
(Pre-SET) 		5 TRP A 152
TYR A 193
PHE A 217
ASN A 219
HIS A 220
 None
SAM  A 304 (-4.2A)
None
SAM  A 304 (-3.3A)
SAM  A 304 (-4.9A)
 0.64A 6chgC-2r3aA:
9.0		 6chgC-2r3aA:
24.55
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.
2r3a HISTONE-LYSINE
N-METHYLTRANSFERASE
SUV39H2

(Homo sapiens) 		PF00856
(SET)
PF05033
(Pre-SET) 		5 TRP A 152
TYR A 193
PHE A 217
HIS A 220
LEU A 298
 None
SAM  A 304 (-4.2A)
None
SAM  A 304 (-4.9A)
SAM  A 304 (-4.7A)
 1.10A 6chgC-2r3aA:
9.0		 6chgC-2r3aA:
24.55
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2w5z HISTONE-LYSINE
N-METHYLTRANSFERASE
HRX

(Homo sapiens) 		PF00856
(SET) 		7 ILE A3838
HIS A3839
TYR A3883
PHE A3904
ASN A3906
HIS A3907
LEU A3968
 SAH  A4971 (-4.3A)
SAH  A4971 (-3.5A)
None
None
SAH  A4971 (-3.1A)
SAH  A4971 (-4.7A)
SAH  A4971 ( 4.9A)
 0.91A 6chgC-2w5zA:
13.9		 6chgC-2w5zA:
42.78
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.
2z87 CHONDROITIN SYNTHASE

(Escherichia
coli) 		PF00535
(Glycos_transf_2) 		5 ILE A 660
SER A 575
TYR A 677
LEU A 658
LEU A 610
 None
 1.35A 6chgC-2z87A:
undetectable		 6chgC-2z87A:
14.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3b46 AMINOTRANSFERASE
BNA3

(Saccharomyces
cerevisiae) 		PF00155
(Aminotran_1_2) 		5 ILE A 128
TYR A 165
PHE A 148
LEU A 129
LEU A 136
 None
 1.37A 6chgC-3b46A:
undetectable		 6chgC-3b46A:
16.67
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.
3bo5 HISTONE-LYSINE
N-METHYLTRANSFERASE
SETMAR

(Homo sapiens) 		PF00856
(SET)
PF05033
(Pre-SET) 		6 TRP A 137
SER A 176
TYR A 178
PHE A 207
ASN A 209
HIS A 210
 None
SAH  A 305 ( 3.7A)
SAH  A 305 (-4.0A)
None
SAH  A 305 (-3.4A)
None
 0.76A 6chgC-3bo5A:
8.8		 6chgC-3bo5A:
22.07
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.
3bo5 HISTONE-LYSINE
N-METHYLTRANSFERASE
SETMAR

(Homo sapiens) 		PF00856
(SET)
PF05033
(Pre-SET) 		6 TRP A 137
SER A 176
TYR A 178
PHE A 207
HIS A 210
LEU A 284
 None
SAH  A 305 ( 3.7A)
SAH  A 305 (-4.0A)
None
None
SAH  A 305 (-4.5A)
 1.00A 6chgC-3bo5A:
8.8		 6chgC-3bo5A:
22.07
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.
3cpi RAB GDP-DISSOCIATION
INHIBITOR

(Saccharomyces
cerevisiae) 		PF00996
(GDI) 		5 ILE G 100
ASN G  97
HIS G 101
LEU G  99
LEU G  27
 None
 1.28A 6chgC-3cpiG:
undetectable		 6chgC-3cpiG:
16.82
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.
3f4b ENOYL-ACYL CARRIER
PROTEIN REDUCTASE

(Plasmodium
berghei) 		PF13561
(adh_short_C2) 		5 ILE A 162
ASN A 158
SER A 232
SER A 229
TYR A 228
 None
 1.48A 6chgC-3f4bA:
undetectable		 6chgC-3f4bA:
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.
3f4b ENOYL-ACYL CARRIER
PROTEIN REDUCTASE

(Plasmodium
berghei) 		PF13561
(adh_short_C2) 		5 ILE A 162
SER A 232
SER A 229
TYR A 228
LEU A 152
 None
 1.13A 6chgC-3f4bA:
undetectable		 6chgC-3f4bA:
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.
3jro FUSION PROTEIN OF
PROTEIN TRANSPORT
PROTEIN SEC13 AND
NUCLEOPORIN NUP145

(Saccharomyces
cerevisiae) 		PF00400
(WD40)
PF12110
(Nup96) 		5 HIS A1490
TYR A1453
PHE A1497
LEU A1487
LEU A1180
 None
 1.42A 6chgC-3jroA:
undetectable		 6chgC-3jroA:
12.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3m3w PROTEIN KINASE C AND
CASEIN KINASE II
SUBSTRATE PROTEIN 3

(Mus musculus) 		PF00611
(FCH) 		5 HIS A 250
SER A 257
SER A 258
HIS A 252
LEU A 247
 None
 1.25A 6chgC-3m3wA:
undetectable		 6chgC-3m3wA:
19.03
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.
3nqk UNCHARACTERIZED
PROTEIN

(Bacteroides
ovatus) 		PF14274
(DUF4361)
PF16343
(DUF4973) 		5 ILE A 219
ASN A 179
SER A 273
SER A 272
LEU A 250
 None
 1.42A 6chgC-3nqkA:
undetectable		 6chgC-3nqkA:
21.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ooi HISTONE-LYSINE
N-METHYLTRANSFERASE,
H3 LYSINE-36 AND H4
LYSINE-20 SPECIFIC

(Homo sapiens) 		PF00856
(SET) 		6 TRP A 103
TYR A 146
PHE A 167
ASN A 169
HIS A 170
LEU A 230
 None
SAM  A 237 (-4.1A)
None
SAM  A 237 (-3.3A)
SAM  A 237 (-4.7A)
SAM  A 237 (-4.8A)
 0.87A 6chgC-3ooiA:
10.4		 6chgC-3ooiA:
26.92
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3ope PROBABLE
HISTONE-LYSINE
N-METHYLTRANSFERASE
ASH1L

(Homo sapiens) 		PF00856
(SET) 		5 TRP A2152
TYR A2194
PHE A2215
ASN A2217
HIS A2218
 None
SAM  A   7 (-3.4A)
None
SAM  A   7 (-3.9A)
None
 0.51A 6chgC-3opeA:
10.7		 6chgC-3opeA:
31.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3un6 HYPOTHETICAL PROTEIN
SAOUHSC_00137

(Staphylococcus
aureus) 		PF13379
(NMT1_2) 		5 ILE A 142
HIS A 149
ASN A 118
HIS A 144
LEU A  96
 None
ZN  A 326 ( 4.6A)
ZN  A 325 ( 4.7A)
PO4  A 329 (-3.8A)
None
 1.37A 6chgC-3un6A:
undetectable		 6chgC-3un6A:
18.93
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3vjf WA20

(synthetic
construct) 		no annotation 5 HIS A  86
SER A  79
ASN A  87
HIS A  84
LEU A  89
 None
 1.48A 6chgC-3vjfA:
undetectable		 6chgC-3vjfA:
14.94
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.
4egv ACETYL-COA
ACETYLTRANSFERASE

(Mycolicibacterium
smegmatis) 		no annotation 5 ASN A 257
SER A 222
SER A 221
PHE A  15
LEU A 366
 None
 1.09A 6chgC-4egvA:
undetectable		 6chgC-4egvA:
14.20
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.
4fmu HISTONE-LYSINE
N-METHYLTRANSFERASE
SETD2

(Homo sapiens) 		PF00856
(SET) 		5 TRP A1562
TYR A1605
PHE A1626
ASN A1628
HIS A1629
 None
0UM  A1804 (-4.2A)
0UM  A1804 (-4.7A)
0UM  A1804 (-3.3A)
None
 0.47A 6chgC-4fmuA:
10.2		 6chgC-4fmuA:
23.81
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.
4fmu HISTONE-LYSINE
N-METHYLTRANSFERASE
SETD2

(Homo sapiens) 		PF00856
(SET) 		5 TRP A1562
TYR A1605
PHE A1626
HIS A1629
LEU A1689
 None
0UM  A1804 (-4.2A)
0UM  A1804 (-4.7A)
None
0UM  A1804 (-4.8A)
 0.89A 6chgC-4fmuA:
10.2		 6chgC-4fmuA:
23.81
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.
4id9 SHORT-CHAIN
DEHYDROGENASE/REDUCT
ASE

(Agrobacterium
fabrum) 		PF01370
(Epimerase) 		5 HIS A 146
SER A  94
HIS A  63
LEU A 142
LEU A  89
 None
 1.34A 6chgC-4id9A:
undetectable		 6chgC-4id9A:
17.02
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.
4k2b NTD BIOSYNTHESIS
OPERON PROTEIN NTDA

(Bacillus
subtilis) 		PF01041
(DegT_DnrJ_EryC1) 		5 ILE A 170
SER A 152
ASN A 149
HIS A 407
LEU A 400
 None
 1.33A 6chgC-4k2bA:
undetectable		 6chgC-4k2bA:
15.62
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.
4kav YHBX/YHJW/YIJP/YJDB
FAMILY PROTEIN

(Neisseria
meningitidis) 		PF00884
(Sulfatase) 		5 ASN A 356
SER A 382
ASN A 323
HIS A 378
LEU A 377
 None
None
None
TPO  A 280 ( 4.8A)
None
 1.33A 6chgC-4kavA:
undetectable		 6chgC-4kavA:
20.27
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.
4nky STEROID
17-ALPHA-HYDROXYLASE
/17,20 LYASE

(Homo sapiens) 		PF00067
(p450) 		5 ILE A 205
ASN A 200
SER A 168
ASN A 202
LEU A 485
 3QZ  A 601 ( 3.4A)
None
None
3QZ  A 601 (-3.5A)
None
 1.34A 6chgC-4nkyA:
undetectable		 6chgC-4nkyA:
15.48
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.
4qeo HISTONE-LYSINE
N-METHYLTRANSFERASE,
H3 LYSINE-9 SPECIFIC
SUVH4

(Arabidopsis
thaliana) 		PF00856
(SET)
PF02182
(SAD_SRA)
PF05033
(Pre-SET) 		6 TRP A 458
TYR A 493
PHE A 549
ASN A 551
HIS A 552
LEU A 623
 SAH  A 801 (-4.9A)
SAH  A 801 (-4.0A)
None
SAH  A 801 (-3.2A)
None
None
 0.75A 6chgC-4qeoA:
13.2		 6chgC-4qeoA:
16.70
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.
4w2r ENHANCER OF ZESTE 2
POLYCOMB REPRESSIVE
COMPLEX 2 SUBUNIT

(Anolis
carolinensis) 		no annotation 5 TRP A 521
SER A 561
PHE A 583
ASN A 585
HIS A 586
 None
None
CJD  A 708 (-4.8A)
CJD  A 708 (-3.5A)
None
 0.69A 6chgC-4w2rA:
8.5		 6chgC-4w2rA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4wzb NITROGENASE
MOLYBDENUM-IRON
PROTEIN ALPHA CHAIN

(Azotobacter
vinelandii) 		PF00148
(Oxidored_nitro) 		5 ILE A  79
ASN A 113
SER A 152
TYR A  64
LEU A 131
 None
None
None
CLF  A1498 (-4.7A)
None
 1.33A 6chgC-4wzbA:
undetectable		 6chgC-4wzbA:
17.20
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.
4y05 KINESIN-LIKE PROTEIN
KIF2C

(Homo sapiens) 		PF00225
(Kinesin) 		5 ILE A 236
ASN A 229
SER A 570
SER A 571
LEU A 268
 None
 1.45A 6chgC-4y05A:
undetectable		 6chgC-4y05A:
17.58
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.
5aor DOSAGE COMPENSATION
REGULATOR

(Drosophila
melanogaster) 		PF00270
(DEAD)
PF00271
(Helicase_C)
PF04408
(HA2)
PF07717
(OB_NTP_bind) 		5 ILE A 886
SER A 915
HIS A 922
LEU A 883
LEU A1001
 None
 1.37A 6chgC-5aorA:
undetectable		 6chgC-5aorA:
9.35
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.
5btx LPG1496

(Legionella
pneumophila) 		no annotation 5 ILE A 102
HIS A 106
ASN A 107
SER A  71
TYR A  69
 None
CMP  A 201 (-3.9A)
CMP  A 201 ( 4.2A)
None
CMP  A 201 (-3.6A)
 1.48A 6chgC-5btxA:
undetectable		 6chgC-5btxA:
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.
5djs TETRATRICOPEPTIDE
TPR_2 REPEAT PROTEIN

(Thermobaculum
terrenum) 		PF13181
(TPR_8)
PF13844
(Glyco_transf_41) 		5 SER A  78
TYR A 110
ASN A  85
LEU A  87
LEU A  66
 None
 1.43A 6chgC-5djsA:
undetectable		 6chgC-5djsA:
14.23
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5f6l HISTONE-LYSINE
N-METHYLTRANSFERASE
2A

(Homo sapiens) 		PF00856
(SET) 		5 ILE A3838
HIS A3839
PHE A3904
ASN A3906
HIS A3907
 SAH  A4001 (-4.3A)
SAH  A4001 (-3.5A)
SAH  A4001 (-4.9A)
SAH  A4001 (-3.0A)
SAH  A4001 (-4.9A)
 0.30A 6chgC-5f6lA:
17.1		 6chgC-5f6lA:
49.38
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5f6l HISTONE-LYSINE
N-METHYLTRANSFERASE
2A

(Homo sapiens) 		PF00856
(SET) 		5 ILE A3838
TYR A3883
PHE A3904
ASN A3906
HIS A3907
 SAH  A4001 (-4.3A)
None
SAH  A4001 (-4.9A)
SAH  A4001 (-3.0A)
SAH  A4001 (-4.9A)
 0.60A 6chgC-5f6lA:
17.1		 6chgC-5f6lA:
49.38
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5f6l HISTONE-LYSINE
N-METHYLTRANSFERASE
2A

(Homo sapiens) 		PF00856
(SET) 		5 ILE A3838
TYR A3883
PHE A3904
ASN A3906
LEU A3955
 SAH  A4001 (-4.3A)
None
SAH  A4001 (-4.9A)
SAH  A4001 (-3.0A)
None
 1.29A 6chgC-5f6lA:
17.1		 6chgC-5f6lA:
49.38
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.
5fgn LIPOOLIGOSACCHARIDE
PHOSPHOETHANOLAMINE
TRANSFERASE A

(Neisseria
meningitidis) 		PF00884
(Sulfatase)
PF08019
(DUF1705) 		5 ASN A 356
SER A 382
ASN A 323
HIS A 378
LEU A 377
 None
 1.28A 6chgC-5fgnA:
undetectable		 6chgC-5fgnA:
16.16
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.
5fmg PROTEASOME SUBUNIT
BETA TYPE

(Plasmodium
falciparum) 		PF00227
(Proteasome) 		5 ILE L 179
HIS L 180
ASN L 182
HIS L 178
LEU L 149
 None
 1.07A 6chgC-5fmgL:
undetectable		 6chgC-5fmgL:
21.70
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.
5jlc LANOSTEROL 14-ALPHA
DEMETHYLASE

([Candida]
glabrata) 		PF00067
(p450) 		5 ILE A 113
SER A 455
HIS A 110
LEU A 384
LEU A 463
 None
None
None
HEM  A 601 (-3.6A)
None
 1.02A 6chgC-5jlcA:
undetectable		 6chgC-5jlcA:
15.26
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.
5ldd CCZ1

(Chaetomium
thermophilum) 		PF08217
(DUF1712) 		5 ILE B  22
ASN B  24
SER B 216
SER B 217
LEU B 208
 None
 1.24A 6chgC-5lddB:
undetectable		 6chgC-5lddB:
19.29
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.
5ls6 HISTONE-LYSINE
N-METHYLTRANSFERASE
EZH2,HISTONE-LYSINE
N-METHYLTRANSFERASE
EZH2,HISTONE-LYSINE
N-METHYLTRANSFERASE
EZH2

(Homo sapiens) 		PF00856
(SET)
PF11616
(EZH2_WD-Binding) 		5 TRP A 624
SER A 664
PHE A 686
ASN A 688
HIS A 689
 None
None
74D  A 809 (-3.9A)
74D  A 809 (-3.0A)
None
 0.92A 6chgC-5ls6A:
12.0		 6chgC-5ls6A:
10.17
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.
5lsu HISTONE-LYSINE
N-METHYLTRANSFERASE
NSD2

(Homo sapiens) 		PF00856
(SET) 		5 TRP A1075
TYR A1118
PHE A1139
ASN A1141
HIS A1142
 None
SAM  A1304 (-3.8A)
SAM  A1304 (-4.7A)
SAM  A1304 (-2.9A)
SAM  A1304 (-4.6A)
 0.39A 6chgC-5lsuA:
10.4		 6chgC-5lsuA:
26.32
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.
5tuy HISTONE-LYSINE
N-METHYLTRANSFERASE
EHMT2

(Homo sapiens) 		PF00856
(SET)
PF05033
(Pre-SET) 		5 TRP A1050
TYR A1085
PHE A1110
ASN A1112
HIS A1113
 None
SAM  A1505 (-4.0A)
None
SAM  A1505 (-3.4A)
SAM  A1505 (-4.7A)
 0.37A 6chgC-5tuyA:
8.7		 6chgC-5tuyA:
29.96
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.
5v1w GLYCOSIDE HYDROLASE

(Bacillus
halodurans) 		PF03639
(Glyco_hydro_81) 		5 HIS A 713
ASN A 717
SER A 357
LEU A 369
LEU A 399
 EDO  A 820 (-3.8A)
None
EDO  A 820 (-4.0A)
None
None
 1.44A 6chgC-5v1wA:
undetectable		 6chgC-5v1wA:
11.36
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.
5vsd HISTONE-LYSINE
N-METHYLTRANSFERASE
EHMT1

(Homo sapiens) 		PF00856
(SET)
PF05033
(Pre-SET) 		6 TRP A1138
SER A1172
TYR A1173
PHE A1198
ASN A1200
HIS A1201
 None
SAM  A3001 (-3.7A)
SAM  A3001 (-4.0A)
None
SAM  A3001 (-3.4A)
SAM  A3001 (-4.6A)
 1.15A 6chgC-5vsdA:
9.1		 6chgC-5vsdA:
29.03
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.
5w4m TRANSCRIPTIONAL
REGULATOR

(Streptococcus
dysgalactiae) 		no annotation 5 ILE A 211
ASN A 190
TYR A 266
HIS A 231
LEU A 207
 None
None
DMS  A 305 (-3.6A)
None
None
 1.18A 6chgC-5w4mA:
undetectable		 6chgC-5w4mA:
20.44
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.
5wg6 HISTONE-LYSINE
N-METHYLTRANSFERASE
EZH2,POLYCOMB
PROTEIN SUZ12
(E.C.2.1.1.43)
CHIMERA

(Homo sapiens) 		no annotation 5 TRP A 624
SER A 664
PHE A 686
ASN A 688
HIS A 689
 None
None
A9G  A9009 (-3.6A)
A9G  A9009 (-3.1A)
None
 0.71A 6chgC-5wg6A:
8.7		 6chgC-5wg6A:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5wqk SULFURTRANSFERASE

(Mus musculus) 		PF00581
(Rhodanese) 		5 ILE A 288
HIS A 204
SER A 208
HIS A 287
LEU A 173
 None
 1.46A 6chgC-5wqkA:
undetectable		 6chgC-5wqkA:
18.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5xl2 HEMAGGLUTININ

(Influenza A
virus) 		PF00509
(Hemagglutinin) 		5 ILE A 286
HIS A  43
HIS A 280
LEU A  44
LEU A  47
 None
 1.19A 6chgC-5xl2A:
undetectable		 6chgC-5xl2A:
15.15
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.
5xsq NUCLEOPROTEIN

(Marburg
marburgvirus) 		PF05505
(Ebola_NP) 		5 ILE A 181
HIS A 182
ASN A 186
TYR A  49
LEU A  65
 None
 1.29A 6chgC-5xsqA:
undetectable		 6chgC-5xsqA:
18.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5zbh NEUROPEPTIDE Y
RECEPTOR TYPE 1,T4
LYSOZYME,NEUROPEPTID
E Y RECEPTOR TYPE 1

(Homo sapiens;
Escherichia
virus T4) 		no annotation 5 ILE A  65
ASN A 324
ASN A  76
LEU A  61
LEU A  82
 None
 1.37A 6chgC-5zbhA:
undetectable		 6chgC-5zbhA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6b7t GREEN FLUORESCENT
PROTEIN,GREEN
FLUORESCENT PROTEIN

(Aequorea
victoria) 		no annotation 5 HIS A -15
SER A -13
SER A -12
ASN A 179
HIS A -16
 None
None
GYS  A  96 ( 3.9A)
None
None
 1.39A 6chgC-6b7tA:
undetectable		 6chgC-6b7tA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6c54 NUCLEOPROTEIN

(Zaire
ebolavirus) 		no annotation 5 ILE A 215
HIS A 216
SER A  93
TYR A  83
LEU A  99
 None
 1.36A 6chgC-6c54A:
undetectable		 6chgC-6c54A:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6cen HISTONE-LYSINE
N-METHYLTRANSFERASE
NSD3

(Homo sapiens) 		no annotation 5 TRP A1157
TYR A1200
PHE A1221
ASN A1223
HIS A1224
 None
SAM  A1301 (-3.9A)
None
SAM  A1301 (-3.2A)
None
 0.44A 6chgC-6cenA:
10.3		 6chgC-6cenA:
29.00