SIMILAR PATTERNS OF AMINO ACIDS FOR 6BP4_A_SAMA505

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
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1peg HISTONE H3
METHYLTRANSFERASE
DIM-5

(Neurospora
crassa) 		PF00856
(SET)
PF05033
(Pre-SET) 		7 GLY A 160
TRP A 161
ARG A 238
HIS A 242
TYR A 283
CYH A 308
LEU A 317
 SAH  A 319 ( 4.6A)
SAH  A 319 (-4.8A)
SAH  A 319 (-3.6A)
SAH  A 319 (-4.3A)
SAH  A 319 (-4.7A)
ZN  A   4 (-2.2A)
SAH  A 319 (-3.9A)
 0.91A 6bp4A-1pegA:
28.3		 6bp4A-1pegA:
37.76
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.
1r5j PUTATIVE
PHOSPHOTRANSACETYLAS
E

(Streptococcus
pyogenes) 		PF01515
(PTA_PTB) 		5 GLY A  50
THR A  70
TYR A  69
ARG A  56
LEU A  59
 None
 1.38A 6bp4A-1r5jA:
undetectable		 6bp4A-1r5jA:
25.48
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.
1v9p DNA LIGASE

(Thermus
filiformis) 		PF01653
(DNA_ligase_aden)
PF03120
(DNA_ligase_OB)
PF12826
(HHH_2)
PF14520
(HHH_5) 		5 GLY A 145
THR A  72
ARG A  74
ARG A 209
LEU A 208
 None
 1.47A 6bp4A-1v9pA:
undetectable		 6bp4A-1v9pA:
18.52
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.
2fk9 PROTEIN KINASE C,
ETA TYPE

(Homo sapiens) 		PF00168
(C2) 		5 GLY A  21
THR A  67
TYR A  68
CYH A 101
LEU A  45
 None
 1.45A 6bp4A-2fk9A:
undetectable		 6bp4A-2fk9A:
16.51
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2r3a HISTONE-LYSINE
N-METHYLTRANSFERASE
SUV39H2

(Homo sapiens) 		PF00856
(SET)
PF05033
(Pre-SET) 		7 GLY A 151
TRP A 152
HIS A 220
TYR A 261
LYS A 288
CYH A 289
LEU A 298
 SAM  A 304 (-3.5A)
None
SAM  A 304 (-4.9A)
SAM  A 304 (-4.9A)
None
ZN  A 300 ( 2.3A)
SAM  A 304 (-4.7A)
 0.89A 6bp4A-2r3aA:
29.0		 6bp4A-2r3aA:
38.44
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) 		5 GLY A3840
HIS A3907
TYR A3944
CYH A3959
LEU A3968
 SAH  A4971 ( 3.7A)
SAH  A4971 (-4.7A)
SAH  A4971 (-4.9A)
ZN  A4970 (-2.3A)
SAH  A4971 ( 4.9A)
 0.66A 6bp4A-2w5zA:
11.5		 6bp4A-2w5zA:
30.26
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3bo5 HISTONE-LYSINE
N-METHYLTRANSFERASE
SETMAR

(Homo sapiens) 		PF00856
(SET)
PF05033
(Pre-SET) 		8 LYS A 135
GLY A 136
TRP A 137
ARG A 206
HIS A 210
TYR A 248
CYH A 275
LEU A 284
 None
SAH  A 305 (-3.8A)
None
None
None
SAH  A 305 (-4.9A)
ZN  A 304 ( 2.3A)
SAH  A 305 (-4.5A)
 0.74A 6bp4A-3bo5A:
25.2		 6bp4A-3bo5A:
32.92
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.
3hym CELL DIVISION CYCLE
PROTEIN 16 HOMOLOG

(Homo sapiens) 		PF13424
(TPR_12) 		5 GLY B 334
TYR B 242
HIS B 368
TYR B 243
LEU B 369
 None
 1.38A 6bp4A-3hymB:
undetectable		 6bp4A-3hymB:
22.97
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.
3n2z LYSOSOMAL PRO-X
CARBOXYPEPTIDASE

(Homo sapiens) 		PF05577
(Peptidase_S28) 		5 GLY B 104
TRP B 107
TYR B 291
TYR B 293
LEU B 457
 None
 1.50A 6bp4A-3n2zB:
undetectable		 6bp4A-3n2zB:
18.89
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.
3n71 HISTONE LYSINE
METHYLTRANSFERASE
SMYD1

(Mus musculus) 		PF00856
(SET)
PF01753
(zf-MYND) 		5 LYS A  17
GLY A  18
HIS A 206
TYR A 252
CYH A 274
 SFG  A 491 (-4.7A)
SFG  A 491 ( 4.2A)
None
SFG  A 491 (-4.8A)
ZN  A 497 (-2.2A)
 1.35A 6bp4A-3n71A:
5.4		 6bp4A-3n71A:
18.61
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.
3ogk CORONATINE-INSENSITI
VE PROTEIN 1

(Arabidopsis
thaliana) 		no annotation 5 GLY B  98
THR B  62
TYR B 571
TYR B 517
LEU B 569
 None
 1.39A 6bp4A-3ogkB:
undetectable		 6bp4A-3ogkB:
19.50
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.
3ooi HISTONE-LYSINE
N-METHYLTRANSFERASE,
H3 LYSINE-36 AND H4
LYSINE-20 SPECIFIC

(Homo sapiens) 		PF00856
(SET) 		5 GLY A 102
HIS A 170
LYS A 220
CYH A 221
LEU A 230
 SAM  A 237 ( 3.7A)
SAM  A 237 (-4.7A)
None
ZN  A 232 (-2.3A)
SAM  A 237 (-4.8A)
 0.85A 6bp4A-3ooiA:
18.8		 6bp4A-3ooiA:
27.57
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.
3ooi HISTONE-LYSINE
N-METHYLTRANSFERASE,
H3 LYSINE-36 AND H4
LYSINE-20 SPECIFIC

(Homo sapiens) 		PF00856
(SET) 		5 GLY A 102
HIS A 170
TYR A 207
LYS A 220
CYH A 221
 SAM  A 237 ( 3.7A)
SAM  A 237 (-4.7A)
None
None
ZN  A 232 (-2.3A)
 0.63A 6bp4A-3ooiA:
18.8		 6bp4A-3ooiA:
27.57
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.
3ooi HISTONE-LYSINE
N-METHYLTRANSFERASE,
H3 LYSINE-36 AND H4
LYSINE-20 SPECIFIC

(Homo sapiens) 		PF00856
(SET) 		6 GLY A 102
TRP A 103
ARG A 166
HIS A 170
CYH A 221
LEU A 230
 SAM  A 237 ( 3.7A)
None
None
SAM  A 237 (-4.7A)
ZN  A 232 (-2.3A)
SAM  A 237 (-4.8A)
 0.84A 6bp4A-3ooiA:
18.8		 6bp4A-3ooiA:
27.57
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.
3ooi HISTONE-LYSINE
N-METHYLTRANSFERASE,
H3 LYSINE-36 AND H4
LYSINE-20 SPECIFIC

(Homo sapiens) 		PF00856
(SET) 		6 GLY A 102
TRP A 103
ARG A 166
HIS A 170
TYR A 207
CYH A 221
 SAM  A 237 ( 3.7A)
None
None
SAM  A 237 (-4.7A)
None
ZN  A 232 (-2.3A)
 0.63A 6bp4A-3ooiA:
18.8		 6bp4A-3ooiA:
27.57
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) 		7 LYS A2150
GLY A2151
TRP A2152
HIS A2218
TYR A2255
LYS A2269
CYH A2270
 None
SAM  A   7 (-3.4A)
None
None
None
None
ZN  A   1 (-2.7A)
 0.68A 6bp4A-3opeA:
17.7		 6bp4A-3opeA:
30.07
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) 		6 LYS A2150
TRP A2152
ARG A2214
HIS A2218
TYR A2255
CYH A2270
 None
None
None
None
None
ZN  A   1 (-2.7A)
 0.87A 6bp4A-3opeA:
17.7		 6bp4A-3opeA:
30.07
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.
3v0w WN1 222-5 FAB
(IGG2A) HEAVY CHAIN
WN1 222-5 FAB
(IGG2A) LIGHT CHAIN

(Mus musculus;
Mus musculus) 		PF07654
(C1-set)
PF07686
(V-set)
PF07654
(C1-set)
PF07686
(V-set) 		5 GLY H  98
ARG H  94
TYR L  36
ARG L  96
LEU L  89
 GMH  H 307 (-4.1A)
SO4  H 314 (-3.2A)
None
None
None
 1.40A 6bp4A-3v0wH:
undetectable		 6bp4A-3v0wH:
21.05
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4fmu HISTONE-LYSINE
N-METHYLTRANSFERASE
SETD2

(Homo sapiens) 		PF00856
(SET) 		7 LYS A1560
GLY A1561
TRP A1562
ARG A1625
HIS A1629
CYH A1680
LEU A1689
 None
0UM  A1804 (-3.5A)
None
0UM  A1804 (-4.9A)
None
ZN  A1803 (-2.2A)
0UM  A1804 (-4.8A)
 0.80A 6bp4A-4fmuA:
17.3		 6bp4A-4fmuA:
30.97
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.
4qeo HISTONE-LYSINE
N-METHYLTRANSFERASE,
H3 LYSINE-9 SPECIFIC
SUVH4

(Arabidopsis
thaliana) 		PF00856
(SET)
PF02182
(SAD_SRA)
PF05033
(Pre-SET) 		7 LYS A 456
GLY A 457
ARG A 548
HIS A 552
TYR A 593
CYH A 614
LEU A 623
 SAH  A 801 (-4.7A)
SAH  A 801 (-3.6A)
SAH  A 801 (-4.8A)
None
None
ZN  A 805 ( 2.4A)
None
 0.72A 6bp4A-4qeoA:
27.2		 6bp4A-4qeoA:
24.08
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.
4qeo HISTONE-LYSINE
N-METHYLTRANSFERASE,
H3 LYSINE-9 SPECIFIC
SUVH4

(Arabidopsis
thaliana) 		PF00856
(SET)
PF02182
(SAD_SRA)
PF05033
(Pre-SET) 		7 LYS A 456
GLY A 457
TRP A 458
HIS A 552
TYR A 593
CYH A 614
LEU A 623
 SAH  A 801 (-4.7A)
SAH  A 801 (-3.6A)
SAH  A 801 (-4.9A)
None
None
ZN  A 805 ( 2.4A)
None
 0.56A 6bp4A-4qeoA:
27.2		 6bp4A-4qeoA:
24.08
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.
5f6l HISTONE-LYSINE
N-METHYLTRANSFERASE
2A

(Homo sapiens) 		PF00856
(SET) 		5 GLY A3840
HIS A3907
TYR A3944
CYH A3959
LEU A3968
 SAH  A4001 (-3.4A)
SAH  A4001 (-4.9A)
SAH  A4001 (-4.9A)
ZN  A4002 (-2.3A)
None
 0.71A 6bp4A-5f6lA:
12.4		 6bp4A-5f6lA:
26.33
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.
5kjm N-LYSINE
METHYLTRANSFERASE
SMYD2

(Homo sapiens) 		PF00856
(SET)
PF01753
(zf-MYND) 		5 LYS A  17
GLY A  18
HIS A 207
TYR A 240
CYH A 262
 None
SAM  A 501 ( 4.1A)
None
6TM  A 502 ( 3.6A)
ZN  A 505 (-2.3A)
 1.42A 6bp4A-5kjmA:
5.6		 6bp4A-5kjmA:
19.91
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.
5lsu HISTONE-LYSINE
N-METHYLTRANSFERASE
NSD2

(Homo sapiens) 		PF00856
(SET) 		7 GLY A1074
TRP A1075
ARG A1138
HIS A1142
TYR A1179
CYH A1193
LEU A1202
 SAM  A1304 ( 3.2A)
None
SAM  A1304 (-4.8A)
SAM  A1304 (-4.6A)
SAM  A1304 (-4.1A)
ZN  A1301 (-2.3A)
SAM  A1304 ( 4.7A)
 0.77A 6bp4A-5lsuA:
19.5		 6bp4A-5lsuA:
29.04
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5tuy HISTONE-LYSINE
N-METHYLTRANSFERASE
EHMT2

(Homo sapiens) 		PF00856
(SET)
PF05033
(Pre-SET) 		6 GLY A1049
TRP A1050
ARG A1109
HIS A1113
TYR A1154
CYH A1170
 SAM  A1505 ( 3.9A)
None
None
SAM  A1505 (-4.7A)
SAM  A1505 (-4.9A)
ZN  A1504 (-2.2A)
 0.74A 6bp4A-5tuyA:
27.5		 6bp4A-5tuyA:
35.65
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5vsd HISTONE-LYSINE
N-METHYLTRANSFERASE
EHMT1

(Homo sapiens) 		PF00856
(SET)
PF05033
(Pre-SET) 		6 GLY A1137
TRP A1138
ARG A1197
HIS A1201
TYR A1242
CYH A1258
 SAM  A3001 (-3.6A)
None
None
SAM  A3001 (-4.6A)
SAM  A3001 (-4.8A)
ZN  A3005 (-2.3A)
 0.75A 6bp4A-5vsdA:
26.8		 6bp4A-5vsdA:
35.92
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.
6cen HISTONE-LYSINE
N-METHYLTRANSFERASE
NSD3

(Homo sapiens) 		no annotation 6 GLY A1156
TRP A1157
ARG A1220
HIS A1224
TYR A1261
CYH A1273
 SAM  A1301 (-3.6A)
None
None
None
SAM  A1301 (-4.9A)
ZN  A1304 ( 2.3A)
 1.48A 6bp4A-6cenA:
19.0		 6bp4A-6cenA:
27.42
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.
6cen HISTONE-LYSINE
N-METHYLTRANSFERASE
NSD3

(Homo sapiens) 		no annotation 7 GLY A1156
TRP A1157
ARG A1220
HIS A1224
TYR A1261
CYH A1275
LEU A1284
 SAM  A1301 (-3.6A)
None
None
None
SAM  A1301 (-4.9A)
ZN  A1304 (-2.3A)
SAM  A1301 (-4.6A)
 0.64A 6bp4A-6cenA:
19.0		 6bp4A-6cenA:
27.42
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.
1do6 SUPEROXIDE REDUCTASE

(Pyrococcus
furiosus) 		PF01880
(Desulfoferrodox) 		3 ILE A  92
ASN A  43
CYH A 111
 None
None
FE  A 200 (-2.4A)
 0.89A 6bp4A-1do6A:
0.0		 6bp4A-1do6A:
17.38
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.
1eje FMN-BINDING PROTEIN

(Methanothermobacter
thermautotrophicus) 		PF01613
(Flavin_Reduct) 		3 ILE A  41
ASN A  82
CYH A 133
 None
 0.73A 6bp4A-1ejeA:
0.0		 6bp4A-1ejeA:
20.79
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.
1f26 NITRIC OXIDE
REDUCTASE

(Fusarium
oxysporum) 		PF00067
(p450) 		3 ILE A 312
ASN A 315
CYH A  52
 None
HEM  A 501 ( 4.3A)
None
 0.78A 6bp4A-1f26A:
undetectable		 6bp4A-1f26A:
20.30
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.
1f2d 1-AMINOCYCLOPROPANE-
1-CARBOXYLATE
DEAMINASE

(Cyberlindnera
saturnus) 		PF00291
(PALP) 		3 ILE A 225
ASN A 273
CYH A 268
 None
 0.87A 6bp4A-1f2dA:
0.0		 6bp4A-1f2dA:
22.54
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.
1nty TRIPLE FUNCTIONAL
DOMAIN PROTEIN

(Homo sapiens) 		PF00169
(PH)
PF00621
(RhoGEF) 		3 ILE A1527
ASN A1519
CYH A1494
 None
 0.83A 6bp4A-1ntyA:
0.0		 6bp4A-1ntyA:
20.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1p9m INTERLEUKIN-6
RECEPTOR BETA CHAIN

(Homo sapiens) 		PF00041
(fn3)
PF06328
(Lep_receptor_Ig)
PF09240
(IL6Ra-bind) 		3 ILE A 113
ASN A 201
CYH A 279
 None
 0.91A 6bp4A-1p9mA:
0.0		 6bp4A-1p9mA:
22.42
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.
1qlb FUMARATE REDUCTASE
IRON-SULFUR PROTEIN

(Wolinella
succinogenes) 		PF13085
(Fer2_3)
PF13183
(Fer4_8) 		3 ILE B 152
ASN B 177
CYH B 214
 SF4  B1242 (-4.7A)
None
F3S  B1241 (-2.1A)
 0.84A 6bp4A-1qlbB:
undetectable		 6bp4A-1qlbB:
23.95
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1r8y GLYCINE
N-METHYLTRANSFERASE

(Mus musculus) 		PF13847
(Methyltransf_31) 		3 ILE A 192
ASN A 138
CYH A 135
 None
 0.92A 6bp4A-1r8yA:
0.0		 6bp4A-1r8yA:
20.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1rhi HUMAN RHINOVIRUS 3
COAT PROTEIN

(Rhinovirus B) 		PF00073
(Rhv) 		3 ILE 2 225
ASN 2 172
CYH 2  79
 None
 0.92A 6bp4A-1rhi2:
0.0		 6bp4A-1rhi2:
22.01
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.
1srq GTPASE-ACTIVATING
PROTEIN 1

(Homo sapiens) 		PF02145
(Rap_GAP) 		3 ILE A 189
ASN A 371
CYH A 376
 None
 0.88A 6bp4A-1srqA:
undetectable		 6bp4A-1srqA:
21.14
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.
1u05 ORF, CONSERVED
HYPOTHETICAL PROTEIN

(Shigella
flexneri) 		PF02578
(Cu-oxidase_4) 		3 ILE A  23
ASN A 221
CYH A 216
 None
 0.81A 6bp4A-1u05A:
undetectable		 6bp4A-1u05A:
21.29
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.
1v9l GLUTAMATE
DEHYDROGENASE

(Pyrobaculum
islandicum) 		PF00208
(ELFV_dehydrog)
PF02812
(ELFV_dehydrog_N) 		3 ILE A 141
ASN A  94
CYH A  62
 None
 0.87A 6bp4A-1v9lA:
undetectable		 6bp4A-1v9lA:
22.30
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.
1vmk PURINE NUCLEOSIDE
PHOSPHORYLASE

(Thermotoga
maritima) 		PF01048
(PNP_UDP_1) 		3 ILE A 115
ASN A 228
CYH A 225
 None
GUN  A 300 (-3.3A)
None
 0.70A 6bp4A-1vmkA:
undetectable		 6bp4A-1vmkA:
19.14
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.
1wu2 MOLYBDOPTERIN
BIOSYNTHESIS MOEA
PROTEIN

(Pyrococcus
horikoshii) 		PF00994
(MoCF_biosynth)
PF03453
(MoeA_N)
PF03454
(MoeA_C) 		3 ILE A 188
ASN A 249
CYH A 251
 None
 0.92A 6bp4A-1wu2A:
undetectable		 6bp4A-1wu2A:
21.12
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.
1xfi UNKNOWN PROTEIN

(Arabidopsis
thaliana) 		PF01937
(DUF89) 		3 ILE A 254
ASN A 291
CYH A 259
 None
 0.84A 6bp4A-1xfiA:
undetectable		 6bp4A-1xfiA:
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.
1ygg PHOSPHOENOLPYRUVATE
CARBOXYKINASE

(Actinobacillus
succinogenes) 		PF01293
(PEPCK_ATP) 		3 ILE A 341
ASN A 280
CYH A 233
 None
 0.90A 6bp4A-1yggA:
undetectable		 6bp4A-1yggA:
19.50
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.
1yi7 BETA-XYLOSIDASE,
FAMILY 43 GLYCOSYL
HYDROLASE

(Clostridium
acetobutylicum) 		PF04616
(Glyco_hydro_43) 		3 ILE A  27
ASN A   6
CYH A 247
 None
 0.83A 6bp4A-1yi7A:
undetectable		 6bp4A-1yi7A:
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.
1yif BETA-1,4-XYLOSIDASE

(Bacillus
subtilis) 		PF04616
(Glyco_hydro_43) 		3 ILE A  26
ASN A   5
CYH A 246
 None
 0.84A 6bp4A-1yifA:
undetectable		 6bp4A-1yifA:
20.30
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.
2b0a HYPOTHETICAL PROTEIN
MJ0783

(Methanocaldococcus
jannaschii) 		PF04199
(Cyclase) 		3 ILE A  36
ASN A  11
CYH A  42
 None
 0.84A 6bp4A-2b0aA:
undetectable		 6bp4A-2b0aA:
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.
2bex RIBONUCLEASE
INHIBITOR

(Homo sapiens) 		PF13516
(LRR_6) 		3 ILE A 181
ASN A 236
CYH A 215
 None
 0.77A 6bp4A-2bexA:
undetectable		 6bp4A-2bexA:
21.58
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.
2bnh RIBONUCLEASE
INHIBITOR

(Sus scrofa) 		PF13516
(LRR_6) 		3 ILE A 177
ASN A 232
CYH A 211
 None
 0.75A 6bp4A-2bnhA:
undetectable		 6bp4A-2bnhA:
21.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2i99 MU-CRYSTALLIN
HOMOLOG

(Homo sapiens) 		PF02423
(OCD_Mu_crystall) 		3 ILE A 154
ASN A 224
CYH A 140
 None
 0.79A 6bp4A-2i99A:
undetectable		 6bp4A-2i99A:
24.28
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.
2iic ALPHA-11 GIARDIN

(Giardia
intestinalis) 		no annotation 3 ILE A  93
ASN A 214
CYH A 219
 None
 0.79A 6bp4A-2iicA:
undetectable		 6bp4A-2iicA:
24.72
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ipf (3(17)ALPHA-HYDROXYS
TEROID
DEHYDROGENASE)

(Mus musculus) 		PF00248
(Aldo_ket_red) 		3 ILE A 176
ASN A 316
CYH A  87
 None
 0.85A 6bp4A-2ipfA:
undetectable		 6bp4A-2ipfA:
22.43
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.
2j1o GERANYLGERANYL
PYROPHOSPHATE
SYNTHETASE

(Sinapis alba) 		PF00348
(polyprenyl_synt) 		3 ILE A  17
ASN A  25
CYH A  79
 None
 0.62A 6bp4A-2j1oA:
undetectable		 6bp4A-2j1oA:
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.
2l5o PUTATIVE THIOREDOXIN

(Neisseria
meningitidis) 		PF08534
(Redoxin) 		3 ILE A  48
ASN A  31
CYH A  37
 None
 0.79A 6bp4A-2l5oA:
undetectable		 6bp4A-2l5oA:
18.36
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.
2mrm MEMBRANE PROTEIN

(Escherichia
coli) 		PF00581
(Rhodanese) 		3 ILE A  60
ASN A  73
CYH A  64
 None
 0.83A 6bp4A-2mrmA:
undetectable		 6bp4A-2mrmA:
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.
2mrm MEMBRANE PROTEIN

(Escherichia
coli) 		PF00581
(Rhodanese) 		3 ILE A  86
ASN A  73
CYH A  64
 None
 0.58A 6bp4A-2mrmA:
undetectable		 6bp4A-2mrmA:
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.
2np0 BOTULINUM NEUROTOXIN
TYPE B

(Clostridium
botulinum) 		PF01742
(Peptidase_M27)
PF07951
(Toxin_R_bind_C)
PF07952
(Toxin_trans)
PF07953
(Toxin_R_bind_N) 		3 ILE A 847
ASN A 772
CYH A 777
 None
 0.93A 6bp4A-2np0A:
undetectable		 6bp4A-2np0A:
12.91
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.
2ozo TYROSINE-PROTEIN
KINASE ZAP-70

(Homo sapiens) 		PF00017
(SH2)
PF07714
(Pkinase_Tyr) 		3 ILE A 364
ASN A 336
CYH A 405
 None
 0.88A 6bp4A-2ozoA:
undetectable		 6bp4A-2ozoA:
19.16
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.
2p82 CYSTEINE PROTEASE
ATG4A

(Homo sapiens) 		PF03416
(Peptidase_C54) 		3 ILE A  91
ASN A 165
CYH A 125
 None
 0.88A 6bp4A-2p82A:
undetectable		 6bp4A-2p82A:
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.
2qg7 ETHANOLAMINE KINASE
PV091845

(Plasmodium
vivax) 		PF01633
(Choline_kinase) 		3 ILE A 193
ASN A 366
CYH A 293
 None
 0.76A 6bp4A-2qg7A:
undetectable		 6bp4A-2qg7A:
19.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2qw8 EUGENOL SYNTHASE 1

(Ocimum
basilicum) 		PF05368
(NmrA) 		3 ILE A 301
ASN A 215
CYH A 153
 None
 0.89A 6bp4A-2qw8A:
undetectable		 6bp4A-2qw8A:
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.
2qya UNCHARACTERIZED
CONSERVED PROTEIN

(Methanopyrus
kandleri) 		PF04242
(DUF424) 		3 ILE A   8
ASN A  73
CYH A  80
 None
 0.82A 6bp4A-2qyaA:
undetectable		 6bp4A-2qyaA:
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.
2r4i UNCHARACTERIZED
PROTEIN

(Cytophaga
hutchinsonii) 		PF14534
(DUF4440) 		3 ILE A  69
ASN A  82
CYH A 118
 None
None
IPA  A 126 ( 3.7A)
 0.93A 6bp4A-2r4iA:
undetectable		 6bp4A-2r4iA:
17.38
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) 		3 ILE A3838
ASN A3912
CYH A3845
 SAH  A4971 (-4.3A)
None
None
 0.92A 6bp4A-2w5zA:
11.5		 6bp4A-2w5zA:
30.26
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.
2wzs PUTATIVE
ALPHA-1,2-MANNOSIDAS
E

(Bacteroides
thetaiotaomicron) 		PF07971
(Glyco_hydro_92) 		3 ILE A 583
ASN A 601
CYH A 640
 None
MVL  A 801 ( 3.4A)
None
 0.82A 6bp4A-2wzsA:
undetectable		 6bp4A-2wzsA:
16.85
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.
2ynt GIM-1 PROTEIN

(Pseudomonas
aeruginosa) 		PF00753
(Lactamase_B) 		3 ILE B 216
ASN B  70
CYH B 221
 None
None
ZN  B1298 (-2.2A)
 0.88A 6bp4A-2yntB:
undetectable		 6bp4A-2yntB:
24.10
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.
2yqh UDP-N-ACETYLGLUCOSAM
INE
PYROPHOSPHORYLASE

(Candida
albicans) 		PF01704
(UDPGP) 		3 ILE A 364
ASN A 206
CYH A 221
 None
 0.83A 6bp4A-2yqhA:
undetectable		 6bp4A-2yqhA:
21.56
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.
2zzr UNSATURATED
GLUCURONYL HYDROLASE

(Streptococcus
agalactiae) 		PF07470
(Glyco_hydro_88) 		3 ILE A 377
ASN A  97
CYH A 124
 None
 0.89A 6bp4A-2zzrA:
undetectable		 6bp4A-2zzrA:
18.89
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.
3a30 BIFUNCTIONAL
GLUTATHIONYLSPERMIDI
NE
SYNTHETASE/AMIDASE

(Escherichia
coli) 		PF05257
(CHAP) 		3 ILE A 135
ASN A 106
CYH A 173
 None
 0.85A 6bp4A-3a30A:
undetectable		 6bp4A-3a30A:
20.32
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.
3c2u XYLOSIDASE/ARABINOSI
DASE

(Selenomonas
ruminantium) 		PF04616
(Glyco_hydro_43)
PF07081
(DUF1349) 		3 ILE A  26
ASN A   5
CYH A 246
 None
 0.84A 6bp4A-3c2uA:
undetectable		 6bp4A-3c2uA:
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.
3ctz XAA-PRO
AMINOPEPTIDASE 1

(Homo sapiens) 		PF00557
(Peptidase_M24)
PF01321
(Creatinase_N)
PF16188
(Peptidase_M24_C)
PF16189
(Creatinase_N_2) 		3 ILE A 154
ASN A 149
CYH A  46
 None
 0.90A 6bp4A-3ctzA:
undetectable		 6bp4A-3ctzA:
17.83
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.
3dec BETA-GALACTOSIDASE

(Bacteroides
thetaiotaomicron) 		PF00703
(Glyco_hydro_2)
PF02836
(Glyco_hydro_2_C)
PF02837
(Glyco_hydro_2_N)
PF02929
(Bgal_small_N)
PF16353
(DUF4981) 		3 ILE A 899
ASN A 593
CYH A 533
 None
 0.85A 6bp4A-3decA:
undetectable		 6bp4A-3decA:
15.10
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.
3e7g NITRIC OXIDE
SYNTHASE, INDUCIBLE

(Homo sapiens) 		PF02898
(NO_synthase) 		3 ILE A 107
ASN A 482
CYH A 115
 None
None
ZN  A3001 (-2.6A)
 0.84A 6bp4A-3e7gA:
undetectable		 6bp4A-3e7gA:
19.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3fcj NITROALKANE OXIDASE

(Fusarium
oxysporum) 		PF00441
(Acyl-CoA_dh_1)
PF02771
(Acyl-CoA_dh_N) 		3 ILE A 371
ASN A 393
CYH A 397
 None
None
FAD  A 500 ( 4.1A)
 0.87A 6bp4A-3fcjA:
undetectable		 6bp4A-3fcjA:
21.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ftt PUTATIVE
ACETYLTRANSFERASE
SACOL2570

(Staphylococcus
aureus) 		PF00132
(Hexapep)
PF12464
(Mac)
PF14602
(Hexapep_2) 		3 ILE A  65
ASN A  84
CYH A 107
 None
 0.88A 6bp4A-3fttA:
undetectable		 6bp4A-3fttA:
18.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3gyk 27KDA OUTER MEMBRANE
PROTEIN

(Ruegeria
pomeroyi) 		PF13462
(Thioredoxin_4) 		3 ILE A 103
ASN A  30
CYH A  34
 None
 0.89A 6bp4A-3gykA:
undetectable		 6bp4A-3gykA:
22.15
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.
3h7l ENDOGLUCANASE

(Vibrio
parahaemolyticus) 		PF00759
(Glyco_hydro_9)
PF02927
(CelD_N) 		3 ILE A   8
ASN A 498
CYH A 515
 None
 0.83A 6bp4A-3h7lA:
undetectable		 6bp4A-3h7lA:
19.66
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.
3jck 26S PROTEASOME
REGULATORY SUBUNIT
RPN3

(Saccharomyces
cerevisiae) 		PF01399
(PCI)
PF08375
(Rpn3_C) 		3 ILE A 294
ASN A 314
CYH A 319
 None
 0.91A 6bp4A-3jckA:
undetectable		 6bp4A-3jckA:
18.36
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.
3kre PHOSPHORIBOSYLAMINOI
MIDAZOLE-SUCCINOCARB
OXAMIDE SYNTHASE

(Ehrlichia
chaffeensis) 		PF01259
(SAICAR_synt) 		3 ILE A 117
ASN A 159
CYH A 202
 None
CL  A 401 ( 4.1A)
None
 0.80A 6bp4A-3kreA:
undetectable		 6bp4A-3kreA:
18.79
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.
3kya PUTATIVE PHOSPHATASE

(Bacteroides
thetaiotaomicron) 		PF01833
(TIG) 		3 ILE A 351
ASN A 394
CYH A 424
 CL  A  21 (-4.4A)
None
None
 0.81A 6bp4A-3kyaA:
undetectable		 6bp4A-3kyaA:
19.96
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.
3n3k UBIQUITIN
CARBOXYL-TERMINAL
HYDROLASE 8

(Homo sapiens) 		PF00443
(UCH) 		3 ILE A 854
ASN A 789
CYH A 794
 None
 0.93A 6bp4A-3n3kA:
undetectable		 6bp4A-3n3kA:
19.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3p4e PHOSPHORIBOSYLFORMYL
GLYCINAMIDINE
CYCLO-LIGASE

(Vibrio cholerae) 		PF00586
(AIRS)
PF02769
(AIRS_C) 		3 ILE A  86
ASN A  94
CYH A 161
 None
 0.92A 6bp4A-3p4eA:
undetectable		 6bp4A-3p4eA:
20.72
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3rui UBIQUITIN-LIKE
MODIFIER-ACTIVATING
ENZYME ATG7

(Saccharomyces
cerevisiae) 		PF00899
(ThiF) 		3 ILE A 433
ASN A 474
CYH A 572
 None
None
ZN  A   1 (-2.3A)
 0.85A 6bp4A-3ruiA:
undetectable		 6bp4A-3ruiA:
20.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ue1 PENICILLIN-BINDING
PROTEIN 1A

(Acinetobacter
baumannii) 		PF00905
(Transpeptidase)
PF00912
(Transgly)
PF17092
(PCB_OB) 		3 ILE A 401
ASN A 545
CYH A 578
 None
 0.85A 6bp4A-3ue1A:
undetectable		 6bp4A-3ue1A:
16.71
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.
3ui7 CAMP AND
CAMP-INHIBITED CGMP
3',5'-CYCLIC
PHOSPHODIESTERASE
10A

(Homo sapiens) 		PF00233
(PDEase_I) 		3 ILE A 766
ASN A 731
CYH A 755
 None
 0.82A 6bp4A-3ui7A:
undetectable		 6bp4A-3ui7A:
21.37
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.
3v48 PUTATIVE
AMINOACRYLATE
HYDROLASE RUTD

(Escherichia
coli) 		PF00561
(Abhydrolase_1) 		3 ILE A 109
ASN A 112
CYH A 216
 None
 0.74A 6bp4A-3v48A:
undetectable		 6bp4A-3v48A:
20.06
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.
3vuo NTNHA

(Clostridium
botulinum) 		PF01742
(Peptidase_M27)
PF07953
(Toxin_R_bind_N)
PF08470
(NTNH_C) 		3 ILE A 967
ASN A 895
CYH A 927
 None
 0.76A 6bp4A-3vuoA:
undetectable		 6bp4A-3vuoA:
12.84
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.
4at3 BDNF/NT-3 GROWTH
FACTORS RECEPTOR

(Homo sapiens) 		PF07714
(Pkinase_Tyr) 		3 ILE A 583
ASN A 553
CYH A 623
 None
 0.85A 6bp4A-4at3A:
undetectable		 6bp4A-4at3A:
21.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4bva THIOMORPHOLINE-CARBO
XYLATE DEHYDROGENASE

(Mus musculus) 		PF02423
(OCD_Mu_crystall) 		3 ILE A 153
ASN A 223
CYH A 139
 None
 0.82A 6bp4A-4bvaA:
undetectable		 6bp4A-4bvaA:
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.
4c1n IRON-SULFUR CLUSTER
BINDING PROTEIN

(Carboxydothermus
hydrogenoformans) 		PF14574
(DUF4445) 		3 ILE I 313
ASN I 381
CYH I 395
 None
B12  I1631 (-3.9A)
None
 0.80A 6bp4A-4c1nI:
undetectable		 6bp4A-4c1nI:
20.94
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.
4c1o BETA-XYLOSIDASE

(Parageobacillus
thermoglucosidasius) 		PF03512
(Glyco_hydro_52) 		3 ILE A 580
ASN A 529
CYH A 536
 None
 0.87A 6bp4A-4c1oA:
undetectable		 6bp4A-4c1oA:
17.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4da5 CHOLINE KINASE ALPHA

(Homo sapiens) 		PF01633
(Choline_kinase) 		3 ILE A 379
ASN A 410
CYH A 348
 None
 0.89A 6bp4A-4da5A:
undetectable		 6bp4A-4da5A:
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.
4i0w PROTEASE CSPB

(Clostridium
perfringens) 		PF00082
(Peptidase_S8) 		3 ILE B 210
ASN B 250
CYH B 504
 None
 0.76A 6bp4A-4i0wB:
undetectable		 6bp4A-4i0wB:
21.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4kxr ESPG5

(Mycobacterium
tuberculosis) 		PF14011
(ESX-1_EspG) 		3 ILE C  99
ASN C 135
CYH C  35
 None
 0.61A 6bp4A-4kxrC:
undetectable		 6bp4A-4kxrC:
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.
4lct COP9 SIGNALOSOME
COMPLEX SUBUNIT 1

(Arabidopsis
thaliana) 		PF01399
(PCI)
PF10602
(RPN7) 		3 ILE A 176
ASN A 214
CYH A 219
 None
 0.89A 6bp4A-4lctA:
undetectable		 6bp4A-4lctA:
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.
4o7z PHOSPHORIBOSYLAMINOI
MIDAZOLE-SUCCINOCARB
OXAMIDE SYNTHASE

(Pyrococcus
horikoshii) 		PF01259
(SAICAR_synt) 		3 ILE A 116
ASN A 157
CYH A 197
 None
 0.88A 6bp4A-4o7zA:
undetectable		 6bp4A-4o7zA:
19.81
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.
4ox2 PHOSPHOENOLPYRUVATE
CARBOXYKINASE,
CYTOSOLIC [GTP]

(Rattus
norvegicus) 		PF00821
(PEPCK_C)
PF17297
(PEPCK_N) 		3 ILE A 416
ASN A 330
CYH A 407
 None
 0.81A 6bp4A-4ox2A:
undetectable		 6bp4A-4ox2A:
18.92
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.
4peq RIBONUCLEASE/ANGIOGE
NIN INHIBITOR 1

(Bos taurus) 		PF13516
(LRR_6) 		3 ILE B 177
ASN B 232
CYH B 211
 None
 0.73A 6bp4A-4peqB:
undetectable		 6bp4A-4peqB:
21.56
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.
4qdd 3-KETOSTEROID
9ALPHA-HYDROXYLASE
OXYGENASE

(Rhodococcus
rhodochrous) 		PF00355
(Rieske) 		3 ILE A 170
ASN A 264
CYH A  34
 None
 0.93A 6bp4A-4qddA:
undetectable		 6bp4A-4qddA:
21.67
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.
4rmx PHI92_GP150

(Enterobacteria
phage phi92) 		no annotation 3 ILE A 362
ASN A 451
CYH A 459
 None
 0.76A 6bp4A-4rmxA:
undetectable		 6bp4A-4rmxA:
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.
4wjm RIBOKINASE:CARBOHYDR
ATE KINASE, PFKB

(Brucella
abortus) 		PF00294
(PfkB) 		3 ILE A 128
ASN A  34
CYH A   4
 None
 0.85A 6bp4A-4wjmA:
undetectable		 6bp4A-4wjmA:
22.35
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.
4z26 PUTATIVE GMC-TYPE
OXIDOREDUCTASE R135

(Acanthamoeba
polyphaga
mimivirus) 		PF00732
(GMC_oxred_N)
PF05199
(GMC_oxred_C) 		3 ILE A 456
ASN A 339
CYH A 581
 None
 0.92A 6bp4A-4z26A:
undetectable		 6bp4A-4z26A:
18.65
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.
4z3y BENZOYL-COA
REDUCTASE, PUTATIVE

(Geobacter
metallireducens) 		PF01314
(AFOR_C)
PF02730
(AFOR_N) 		3 ILE A 218
ASN A 301
CYH A  68
 None
 0.87A 6bp4A-4z3yA:
undetectable		 6bp4A-4z3yA:
16.77
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.
4zkt BOTULINUM NEUROTOXIN
TYPE E,
NONTOXIC-NONHEMAGGLU
TININ COMPONENT,
NTNH

(Clostridium
botulinum) 		PF01742
(Peptidase_M27)
PF07953
(Toxin_R_bind_N)
PF08470
(NTNH_C) 		3 ILE B 599
ASN B 622
CYH B 737
 None
 0.87A 6bp4A-4zktB:
undetectable		 6bp4A-4zktB:
13.63
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.
5a30 MITOCHONDRIAL
PROTEIN

(Gallus gallus) 		PF03828
(PAP_assoc) 		3 ILE A 378
ASN A 229
CYH A 339
 None
 0.86A 6bp4A-5a30A:
undetectable		 6bp4A-5a30A:
18.83
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.
5a4a MATERNAL EFFECT
PROTEIN OSKAR

(Drosophila
melanogaster) 		PF17182
(OSK) 		3 ILE A 461
ASN A 482
CYH A 455
 None
 0.92A 6bp4A-5a4aA:
undetectable		 6bp4A-5a4aA:
21.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5e8l HETERODIMERIC
GERANYLGERANYL
PYROPHOSPHATE
SYNTHASE LARGE
SUBUNIT 1,
CHLOROPLASTIC

(Arabidopsis
thaliana) 		PF00348
(polyprenyl_synt) 		3 ILE A  16
ASN A  24
CYH A  78
 None
 0.71A 6bp4A-5e8lA:
undetectable		 6bp4A-5e8lA:
22.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5f6l HISTONE-LYSINE
N-METHYLTRANSFERASE
2A

(Homo sapiens) 		PF00856
(SET) 		3 ILE A3838
ASN A3912
CYH A3845
 SAH  A4001 (-4.3A)
None
None
 0.91A 6bp4A-5f6lA:
12.3		 6bp4A-5f6lA:
26.33
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.
5fhi GLUTATHIONE
S-TRANSFERASE,
PUTATIVE

(Aspergillus
fumigatus) 		PF00043
(GST_C)
PF02798
(GST_N) 		3 ILE A  67
ASN A  99
CYH A 160
 None
GSH  A 301 (-3.2A)
None
 0.83A 6bp4A-5fhiA:
undetectable		 6bp4A-5fhiA:
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.
5h0u MATRIX
METALLOPROTEINASE-14

(Homo sapiens) 		PF00413
(Peptidase_M10) 		3 ILE A 233
ASN A 130
CYH A 127
 None
EPE  A 305 ( 4.6A)
None
 0.80A 6bp4A-5h0uA:
undetectable		 6bp4A-5h0uA:
19.35
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.
5h75 MERSACIDIN
DECARBOXYLASE,IMMUNO
GLOBULIN G-BINDING
PROTEIN A

(Staphylococcus
aureus;
Bacillus sp.
HIL-Y85/54728) 		PF02216
(B)
PF02441
(Flavoprotein) 		3 ILE A 159
ASN A 123
CYH A  16
 None
FAD  A 301 (-4.6A)
FAD  A 301 ( 4.6A)
 0.66A 6bp4A-5h75A:
undetectable		 6bp4A-5h75A:
22.81
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.
5izh RNA-DIRECTED RNA
POLYMERASE L

(Lassa
mammarenavirus) 		PF17296
(ArenaCapSnatch) 		3 ILE A 138
ASN A  58
CYH A 103
 None
 0.89A 6bp4A-5izhA:
undetectable		 6bp4A-5izhA:
22.83
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.
5mrw POTASSIUM-TRANSPORTI
NG ATPASE
ATP-BINDING SUBUNIT

(Escherichia
coli) 		PF00122
(E1-E2_ATPase)
PF00702
(Hydrolase) 		3 ILE B 591
ASN B 603
CYH B 609
 None
 0.91A 6bp4A-5mrwB:
undetectable		 6bp4A-5mrwB:
19.78
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.
5npx POLYPROTEIN
POLYPROTEIN

(Broad bean
stain virus;
Broad bean
stain virus) 		no annotation
no annotation 		3 ILE L 363
ASN S 434
CYH S 391
 None
 0.79A 6bp4A-5npxL:
undetectable		 6bp4A-5npxL:
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.
5nyw PROTEASOME SUBUNIT

(Yersinia
bercovieri) 		no annotation 3 ILE A 137
ASN A 113
CYH A   3
 None
 0.64A 6bp4A-5nywA:
undetectable		 6bp4A-5nywA:
23.96
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.
5or7 CAPSID PROTEIN

(Norwalk virus) 		no annotation 3 ILE A 405
ASN A 266
CYH A 451
 None
NA  A 600 ( 4.2A)
None
 0.93A 6bp4A-5or7A:
undetectable		 6bp4A-5or7A:
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.
5tiw SULFOTRANSFERASE

(Schistosoma
haematobium) 		no annotation 3 ILE A  57
ASN A  36
CYH A  50
 OAQ  A 302 ( 4.9A)
None
None
 0.82A 6bp4A-5tiwA:
undetectable		 6bp4A-5tiwA:
22.98
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.
5uju NAD-DEPENDENT
ALDEHYDE
DEHYDROGENASE

(Burkholderia
multivorans) 		PF00171
(Aldedh) 		3 ILE A 316
ASN A 515
CYH A 343
 None
 0.83A 6bp4A-5ujuA:
undetectable		 6bp4A-5ujuA:
20.30
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.
5utu ADENOSYLHOMOCYSTEINA
SE

(Cryptosporidium
parvum) 		PF00670
(AdoHcyase_NAD)
PF05221
(AdoHcyase) 		3 ILE A 375
ASN A 348
CYH A 262
 None
 0.45A 6bp4A-5utuA:
undetectable		 6bp4A-5utuA:
20.33
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.
5wgg RADICAL SAM DOMAIN
PROTEIN

(Ruminiclostridium
thermocellum) 		PF04055
(Radical_SAM)
PF13186
(SPASM)
PF13353
(Fer4_12) 		3 ILE A 337
ASN A 393
CYH A 400
 None
None
SF4  A 503 (-2.3A)
 0.73A 6bp4A-5wggA:
undetectable		 6bp4A-5wggA:
22.10
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.
5x4t PHOTOACTIVATED
ADENYLYL CYCLASE

(Cyanobacteria) 		PF00211
(Guanylate_cyc)
PF04940
(BLUF) 		3 ILE A 108
ASN A 100
CYH A  41
 None
 0.88A 6bp4A-5x4tA:
undetectable		 6bp4A-5x4tA:
22.40
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.
6br8 PROTEIN A6 HOMOLOG

(Fowlpox virus) 		no annotation 3 ILE A 269
ASN A 261
CYH A 221
 None
 0.69A 6bp4A-6br8A:
undetectable		 6bp4A-6br8A:
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.
6br9 PROTEIN A6 HOMOLOG

(Fowlpox virus) 		no annotation 3 ILE A 269
ASN A 261
CYH A 221
 None
 0.67A 6bp4A-6br9A:
undetectable		 6bp4A-6br9A:
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.
6cud SHORT TRANSIENT
RECEPTOR POTENTIAL
CHANNEL 3

(Homo sapiens) 		no annotation 3 ILE A 766
ASN A 276
CYH A 314
 None
 0.74A 6bp4A-6cudA:
undetectable		 6bp4A-6cudA:
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.
6d6y APRA
METHYLTRANSFERASE 2

(Moorea
bouillonii) 		no annotation 3 ILE A1011
ASN A 911
CYH A 972
 None
 0.92A 6bp4A-6d6yA:
undetectable		 6bp4A-6d6yA:
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.
6du8 -

(-) 		no annotation 3 ILE A 363
ASN A 445
CYH A 115
 None
 0.84A 6bp4A-6du8A:
undetectable		 6bp4A-6du8A:
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.
6fnu METHYLENETETRAHYDROF
OLATE REDUCTASE 1

(Saccharomyces
cerevisiae) 		no annotation 3 ILE A  73
ASN A 103
CYH A  96
 None
 0.87A 6bp4A-6fnuA:
undetectable		 6bp4A-6fnuA:
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.
6gdt -

(-) 		no annotation 3 ILE A   8
ASN A 497
CYH A 514
 None
 0.76A 6bp4A-6gdtA:
undetectable		 6bp4A-6gdtA:
undetectable