SIMILAR PATTERNS OF AMINO ACIDS FOR 1UOF_A_PNNA1312

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.
1c30 CARBAMOYL PHOSPHATE
SYNTHETASE: LARGE
SUBUNIT

(Escherichia
coli) 		PF02142
(MGS)
PF02786
(CPSase_L_D2)
PF02787
(CPSase_L_D3) 		5 ASP A 763
THR A 849
HIS A 781
VAL A 787
SER A 913
 None
None
K  A4009 (-3.9A)
K  A4009 ( 4.4A)
None
 1.42A 1uofA-1c30A:
undetectable		 1uofA-1c30A:
14.43
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1e5i DEACETOXYCEPHALOSPOR
IN C SYNTHASE

(Streptomyces
clavuligerus) 		PF03171
(2OG-FeII_Oxy) 		7 ARG A 179
HIS A 183
ASP A 185
THR A 190
HIS A 243
VAL A 245
VAL A 262
 None
FE2  A 901 ( 3.5A)
FE2  A 901 ( 2.2A)
None
FE2  A 901 ( 3.4A)
None
AKG  A 902 ( 4.8A)
 1.04A 1uofA-1e5iA:
42.9		 1uofA-1e5iA:
99.67
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1e5i DEACETOXYCEPHALOSPOR
IN C SYNTHASE

(Streptomyces
clavuligerus) 		PF03171
(2OG-FeII_Oxy) 		7 ARG A 179
MET A 180
HIS A 183
ASP A 185
THR A 190
HIS A 243
VAL A 245
 None
AKG  A 902 ( 3.7A)
FE2  A 901 ( 3.5A)
FE2  A 901 ( 2.2A)
None
FE2  A 901 ( 3.4A)
None
 1.11A 1uofA-1e5iA:
42.9		 1uofA-1e5iA:
99.67
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1e5i DEACETOXYCEPHALOSPOR
IN C SYNTHASE

(Streptomyces
clavuligerus) 		PF03171
(2OG-FeII_Oxy) 		6 HIS A 183
ASP A 185
THR A 190
ARG A 258
SER A 260
VAL A 262
 FE2  A 901 ( 3.5A)
FE2  A 901 ( 2.2A)
None
AKG  A 902 (-2.8A)
AKG  A 902 (-2.8A)
AKG  A 902 ( 4.8A)
 0.79A 1uofA-1e5iA:
42.9		 1uofA-1e5iA:
99.67
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1e5i DEACETOXYCEPHALOSPOR
IN C SYNTHASE

(Streptomyces
clavuligerus) 		PF03171
(2OG-FeII_Oxy) 		7 HIS A 183
ASP A 185
THR A 190
HIS A 243
VAL A 245
SER A 260
VAL A 262
 FE2  A 901 ( 3.5A)
FE2  A 901 ( 2.2A)
None
FE2  A 901 ( 3.4A)
None
AKG  A 902 (-2.8A)
AKG  A 902 ( 4.8A)
 0.50A 1uofA-1e5iA:
42.9		 1uofA-1e5iA:
99.67
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.
1j6o TATD-RELATED
DEOXYRIBONUCLEASE

(Thermotoga
maritima) 		PF01026
(TatD_DNase) 		5 ASP A 201
HIS A 151
VAL A 149
SER A  57
VAL A  34
 None
 1.49A 1uofA-1j6oA:
undetectable		 1uofA-1j6oA:
21.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ji6 PESTICIDIAL CRYSTAL
PROTEIN CRY3BB

(Bacillus
thuringiensis) 		PF00555
(Endotoxin_M)
PF03944
(Endotoxin_C)
PF03945
(Endotoxin_N) 		5 PHE A 482
HIS A 333
ASP A 336
THR A 367
VAL A 365
 None
 1.08A 1uofA-1ji6A:
undetectable		 1uofA-1ji6A:
19.52
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.
1jr7 HYPOTHETICAL 37.4
KDA PROTEIN IN
ILEY-GABD INTERGENIC
REGION

(Escherichia
coli) 		PF08943
(CsiD) 		5 MET A 157
HIS A 160
ASP A 162
HIS A 292
ARG A 305
 None
FE2  A 501 (-3.9A)
FE2  A 501 (-2.7A)
FE2  A 501 (-3.9A)
None
 0.86A 1uofA-1jr7A:
4.8		 1uofA-1jr7A:
22.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1jr7 HYPOTHETICAL 37.4
KDA PROTEIN IN
ILEY-GABD INTERGENIC
REGION

(Escherichia
coli) 		PF08943
(CsiD) 		5 PHE A 297
MET A 157
HIS A 160
HIS A 292
ARG A 305
 None
None
FE2  A 501 (-3.9A)
FE2  A 501 (-3.9A)
None
 1.49A 1uofA-1jr7A:
4.8		 1uofA-1jr7A:
22.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1krm ADENOSINE DEAMINASE

(Bos taurus) 		PF00962
(A_deaminase) 		5 HIS A  14
ASP A 178
THR A 209
HIS A 211
SER A 288
 PRH  A 401 ( 3.0A)
None
None
ZN  A 501 ( 3.4A)
None
 1.13A 1uofA-1krmA:
undetectable		 1uofA-1krmA:
21.65
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.
2bjs ISOPENICILLIN N
SYNTHETASE

(Aspergillus
nidulans) 		PF03171
(2OG-FeII_Oxy)
PF14226
(DIOX_N) 		6 HIS A 214
ASP A 216
THR A 221
HIS A 270
VAL A 272
ARG A 279
 FE  A1323 ( 3.3A)
FE  A1323 ( 2.5A)
None
FE  A1323 (-3.5A)
None
None
 0.66A 1uofA-2bjsA:
22.1		 1uofA-2bjsA:
23.94
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.
2iuw ALKYLATED REPAIR
PROTEIN ALKB HOMOLOG
3

(Homo sapiens) 		PF13532
(2OG-FeII_Oxy_2) 		6 HIS A 191
ASP A 193
HIS A 257
VAL A 259
ARG A 269
SER A 208
 FE  A 500 ( 3.3A)
FE  A 500 ( 2.6A)
FE  A 500 ( 3.3A)
None
AKG  A 700 (-2.9A)
AKG  A 700 ( 4.8A)
 1.30A 1uofA-2iuwA:
3.4		 1uofA-2iuwA:
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.
2jig PROLYL-4 HYDROXYLASE

(Chlamydomonas
reinhardtii) 		PF13640
(2OG-FeII_Oxy_3) 		5 HIS A 143
ASP A 145
THR A 164
HIS A 227
SER A 239
 ZN  A1252 ( 3.3A)
ZN  A1252 ( 2.4A)
None
ZN  A1252 ( 3.3A)
PD2  A1254 (-3.3A)
 0.60A 1uofA-2jigA:
8.3		 1uofA-2jigA:
22.33
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.
2rds 1-DEOXYPENTALENIC
ACID 11-BETA
HYDROXYLASE
FE(II)/ALPHA-KETOGL
UTARATE DEPENDENT
HYDROXYLASE

(Streptomyces
avermitilis) 		PF05721
(PhyH) 		5 HIS A 137
ASP A 139
HIS A 226
ARG A 240
SER A 242
 FE  A   1 (-3.4A)
FE  A   1 ( 2.6A)
FE  A   1 ( 3.4A)
OGA  A 268 (-2.9A)
OGA  A 268 ( 4.5A)
 1.03A 1uofA-2rdsA:
5.7		 1uofA-2rdsA:
25.00
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.
2rds 1-DEOXYPENTALENIC
ACID 11-BETA
HYDROXYLASE
FE(II)/ALPHA-KETOGL
UTARATE DEPENDENT
HYDROXYLASE

(Streptomyces
avermitilis) 		PF05721
(PhyH) 		5 HIS A 137
ASP A 139
THR A 151
HIS A 226
SER A 242
 FE  A   1 (-3.4A)
FE  A   1 ( 2.6A)
OGA  A 268 (-3.8A)
FE  A   1 ( 3.4A)
OGA  A 268 ( 4.5A)
 0.64A 1uofA-2rdsA:
5.7		 1uofA-2rdsA:
25.00
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.
2rds 1-DEOXYPENTALENIC
ACID 11-BETA
HYDROXYLASE
FE(II)/ALPHA-KETOGL
UTARATE DEPENDENT
HYDROXYLASE

(Streptomyces
avermitilis) 		PF05721
(PhyH) 		5 PHE A  73
HIS A 137
ASP A 139
THR A 151
HIS A 226
 None
FE  A   1 (-3.4A)
FE  A   1 ( 2.6A)
OGA  A 268 (-3.8A)
FE  A   1 ( 3.4A)
 0.88A 1uofA-2rdsA:
5.7		 1uofA-2rdsA:
25.00
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.
2wsu PUTATIVE FIBER
PROTEIN

(Porcine
mastadenovirus
B) 		PF00337
(Gal-bind_lectin) 		5 PHE A 633
ASP A 514
THR A 415
HIS A 670
VAL A 577
 None
None
NO3  A1688 (-3.0A)
None
None
 1.20A 1uofA-2wsuA:
undetectable		 1uofA-2wsuA:
24.80
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.
3dm0 MALTOSE-BINDING
PERIPLASMIC PROTEIN
FUSED WITH RACK1

(Escherichia
coli;
Arabidopsis
thaliana) 		PF00400
(WD40)
PF01547
(SBP_bac_1) 		5 ASP A1037
HIS A1014
VAL A1032
SER A1080
VAL A1066
 None
 1.33A 1uofA-3dm0A:
undetectable		 1uofA-3dm0A:
18.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3dm0 MALTOSE-BINDING
PERIPLASMIC PROTEIN
FUSED WITH RACK1

(Escherichia
coli;
Arabidopsis
thaliana) 		PF00400
(WD40)
PF01547
(SBP_bac_1) 		5 ASP A1126
HIS A1104
VAL A1121
SER A1169
VAL A1153
 None
 1.35A 1uofA-3dm0A:
undetectable		 1uofA-3dm0A:
18.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3itq PROLYL
4-HYDROXYLASE, ALPHA
SUBUNIT DOMAIN
PROTEIN

(Bacillus
anthracis) 		PF13640
(2OG-FeII_Oxy_3) 		5 HIS A 127
ASP A 129
THR A 145
HIS A 193
VAL A 147
 GOL  A 968 (-4.4A)
GOL  A 968 (-2.8A)
GOL  A 968 ( 4.1A)
GOL  A 968 (-4.1A)
None
 0.94A 1uofA-3itqA:
4.2		 1uofA-3itqA:
21.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3kt4 PKHD-TYPE
HYDROXYLASE TPA1

(Saccharomyces
cerevisiae) 		PF10637
(Ofd1_CTDD)
PF13661
(2OG-FeII_Oxy_4) 		6 HIS A 159
ASP A 161
HIS A 227
VAL A 229
ARG A 238
SER A 240
 FE  A 701 (-3.3A)
FE  A 701 (-2.5A)
FE  A 701 (-3.4A)
None
None
None
 0.85A 1uofA-3kt4A:
8.9		 1uofA-3kt4A:
19.06
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.
3on7 OXIDOREDUCTASE,
IRON/ASCORBATE
FAMILY

(Shewanella
oneidensis) 		PF03171
(2OG-FeII_Oxy)
PF14226
(DIOX_N) 		6 HIS A 173
ASP A 175
THR A 180
HIS A 230
VAL A 232
SER A 246
 None
 0.61A 1uofA-3on7A:
22.3		 1uofA-3on7A:
22.12
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.
3on7 OXIDOREDUCTASE,
IRON/ASCORBATE
FAMILY

(Shewanella
oneidensis) 		PF03171
(2OG-FeII_Oxy)
PF14226
(DIOX_N) 		5 HIS A 230
ASP A 175
THR A 180
VAL A 232
SER A 246
 None
 1.43A 1uofA-3on7A:
22.3		 1uofA-3on7A:
22.12
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.
3oox PUTATIVE 2OG-FE(II)
OXYGENASE FAMILY
PROTEIN

(Caulobacter
vibrioides) 		PF03171
(2OG-FeII_Oxy)
PF14226
(DIOX_N) 		6 HIS A 190
ASP A 192
THR A 197
HIS A 247
VAL A 249
SER A 263
 EDO  A 314 (-4.4A)
None
None
EDO  A 314 (-4.5A)
None
None
 0.69A 1uofA-3ooxA:
23.2		 1uofA-3ooxA:
24.57
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.
3ouh EGL NINE HOMOLOG 1

(Homo sapiens) 		PF13640
(2OG-FeII_Oxy_3) 		5 HIS A 313
ASP A 315
THR A 325
HIS A 374
VAL A 376
 FE2  A 600 ( 3.2A)
FE2  A 600 ( 2.5A)
None
FE2  A 600 ( 3.2A)
014  A 417 (-4.8A)
 0.56A 1uofA-3ouhA:
10.4		 1uofA-3ouhA:
22.16
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.
3oui EGL NINE HOMOLOG 1

(Homo sapiens) 		PF13640
(2OG-FeII_Oxy_3) 		5 HIS A 313
ASP A 315
THR A 325
HIS A 374
VAL A 376
 FE2  A   1 ( 3.3A)
FE2  A   1 ( 2.5A)
None
FE2  A   1 ( 3.2A)
42Z  A 393 (-4.9A)
 0.61A 1uofA-3ouiA:
4.4		 1uofA-3ouiA:
19.94
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.
3uyj LYSINE-SPECIFIC
DEMETHYLASE 8

(Homo sapiens) 		PF13621
(Cupin_8) 		5 HIS A 321
ASP A 323
HIS A 400
VAL A 402
SER A 410
 NI  A 501 ( 3.2A)
NI  A 501 ( 2.4A)
NI  A 501 ( 3.4A)
AKG  A 601 (-4.1A)
AKG  A 601 ( 4.7A)
 0.96A 1uofA-3uyjA:
7.0		 1uofA-3uyjA:
22.26
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.
4d6v G PROTEIN BETA
SUBUNIT GIB2

(Cryptococcus
neoformans) 		PF00400
(WD40) 		5 ASP A 126
HIS A 104
VAL A 121
SER A 167
VAL A 151
 None
 1.45A 1uofA-4d6vA:
undetectable		 1uofA-4d6vA:
23.84
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.
4j25 PUTATIVE
UNCHARACTERIZED
PROTEIN

(Pseudomonas
putida) 		PF13640
(2OG-FeII_Oxy_3) 		6 HIS A 124
ASP A 126
HIS A 183
VAL A 185
SER A 194
VAL A 139
 MN  A 401 ( 3.3A)
MN  A 401 ( 2.6A)
MN  A 401 ( 3.3A)
None
OGA  A 402 ( 3.7A)
OGA  A 402 ( 4.9A)
 1.36A 1uofA-4j25A:
9.4		 1uofA-4j25A:
21.54
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.
4lt5 NAEGLERIA TET-LIKE
DIOXYGENASE

(Naegleria
gruberi) 		no annotation 5 HIS A 229
ASP A 231
HIS A 279
VAL A 281
VAL A 293
 MN  A 401 ( 3.4A)
MN  A 401 ( 2.7A)
MN  A 401 ( 3.4A)
OGA  A 413 (-4.8A)
OGA  A 413 (-4.9A)
 0.60A 1uofA-4lt5A:
2.7		 1uofA-4lt5A:
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.
4nhy 2-OXOGLUTARATE AND
IRON-DEPENDENT
OXYGENASE
DOMAIN-CONTAINING
PROTEIN 1

(Homo sapiens) 		PF10637
(Ofd1_CTDD)
PF13661
(2OG-FeII_Oxy_4) 		5 HIS A 155
ASP A 157
HIS A 218
VAL A 220
SER A 232
 MN  A 601 (-3.5A)
MN  A 601 ( 2.5A)
MN  A 601 ( 3.4A)
PD2  A 603 (-4.9A)
PD2  A 603 (-3.1A)
 0.65A 1uofA-4nhyA:
9.3		 1uofA-4nhyA:
20.21
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.
4nrq RNA DEMETHYLASE
ALKBH5

(Homo sapiens) 		PF13532
(2OG-FeII_Oxy_2) 		5 HIS A 204
ASP A 206
HIS A 266
ARG A 277
SER A 219
 MN  A 302 ( 3.6A)
MN  A 302 ( 2.7A)
MN  A 302 ( 3.3A)
PD2  A 301 (-2.7A)
PD2  A 301 ( 4.5A)
 1.46A 1uofA-4nrqA:
8.1		 1uofA-4nrqA:
23.15
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.
4on1 PUTATIVE
METALLOPROTEASE II

(Bacteroides
fragilis) 		PF00413
(Peptidase_M10)
PF16376
(fragilysinNterm) 		5 HIS A 355
THR A 371
HIS A 351
SER A 383
VAL A 362
 ZN  A 400 (-3.2A)
None
ZN  A 400 (-3.2A)
None
None
 1.25A 1uofA-4on1A:
undetectable		 1uofA-4on1A:
20.92
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.
4qax 2,3-BISPHOSPHOGLYCER
ATE-INDEPENDENT
PHOSPHOGLYCERATE
MUTASE

(Staphylococcus
aureus) 		PF01676
(Metalloenzyme)
PF06415
(iPGM_N) 		5 ARG A 153
HIS A 401
ASP A 397
HIS A 456
ARG A 257
 2PG  A 603 (-3.8A)
MN  A 601 (-3.4A)
MN  A 601 (-2.4A)
MN  A 601 (-3.6A)
2PG  A 603 (-2.6A)
 1.44A 1uofA-4qaxA:
undetectable		 1uofA-4qaxA:
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.
4uuo CYTOSOLIC MALATE
DEHYDROGENASE

(Trichomonas
vaginalis) 		PF00056
(Ldh_1_N)
PF02866
(Ldh_1_C) 		5 PHE A 220
ASP A 199
THR A 204
HIS A 177
VAL A 179
 None
 1.38A 1uofA-4uuoA:
undetectable		 1uofA-4uuoA:
22.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4wjv RIBOSOME ASSEMBLY
PROTEIN 4

(Saccharomyces
cerevisiae) 		PF00400
(WD40) 		5 ASP A 423
HIS A 401
VAL A 418
SER A 461
VAL A 447
 None
 1.45A 1uofA-4wjvA:
undetectable		 1uofA-4wjvA:
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.
4xae FERULOYL COA
ORTHO-HYDROXYLASE 1

(Arabidopsis
thaliana) 		PF03171
(2OG-FeII_Oxy)
PF14226
(DIOX_N) 		5 HIS A 235
ASP A 237
HIS A 293
VAL A 295
SER A 305
 NA  A 400 (-3.7A)
NA  A 400 (-2.3A)
NA  A 400 (-3.7A)
None
None
 0.85A 1uofA-4xaeA:
20.2		 1uofA-4xaeA:
21.41
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.
4xae FERULOYL COA
ORTHO-HYDROXYLASE 1

(Arabidopsis
thaliana) 		PF03171
(2OG-FeII_Oxy)
PF14226
(DIOX_N) 		5 HIS A 235
ASP A 237
THR A 242
HIS A 293
VAL A 295
 NA  A 400 (-3.7A)
NA  A 400 (-2.3A)
None
NA  A 400 (-3.7A)
None
 0.54A 1uofA-4xaeA:
20.2		 1uofA-4xaeA:
21.41
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.
5apa ASPARTYL/ASPARAGINYL
BETA-HYDROXYLASE

(Homo sapiens) 		PF05118
(Asp_Arg_Hydrox) 		5 HIS A 679
HIS A 725
VAL A 727
ARG A 735
SER A 668
 NI  A1759 ( 3.2A)
NI  A1759 ( 3.3A)
LMR  A1760 ( 4.9A)
LMR  A1760 (-2.9A)
LMR  A1760 (-2.7A)
 1.23A 1uofA-5apaA:
7.2		 1uofA-5apaA:
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.
5c3o THYMINE DIOXYGENASE

(Neurospora
crassa) 		PF03171
(2OG-FeII_Oxy)
PF14226
(DIOX_N) 		5 HIS A 214
ASP A 216
HIS A 271
VAL A 273
ARG A 286
 CA  A 407 (-3.4A)
CA  A 407 (-2.5A)
CA  A 407 (-3.4A)
None
None
 1.34A 1uofA-5c3oA:
22.6		 1uofA-5c3oA:
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.
5c3o THYMINE DIOXYGENASE

(Neurospora
crassa) 		PF03171
(2OG-FeII_Oxy)
PF14226
(DIOX_N) 		6 HIS A 214
ASP A 216
THR A 221
HIS A 271
VAL A 273
SER A 288
 CA  A 407 (-3.4A)
CA  A 407 (-2.5A)
None
CA  A 407 (-3.4A)
None
None
 0.70A 1uofA-5c3oA:
22.6		 1uofA-5c3oA:
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.
5cg9 TET-LIKE DIOXYGENASE

(Naegleria
gruberi) 		no annotation 5 HIS A 229
ASP A 231
HIS A 279
VAL A 281
VAL A 293
 MN  A 403 ( 3.3A)
MN  A 403 ( 2.5A)
MN  A 403 ( 3.4A)
AKG  A 402 (-4.9A)
AKG  A 402 (-4.8A)
 0.59A 1uofA-5cg9A:
6.3		 1uofA-5cg9A:
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.
5cyk RIBOSOME BIOGENESIS
PROTEIN YTM1

(Chaetomium
thermophilum) 		PF00400
(WD40)
PF08154
(NLE) 		5 ASP A 410
HIS A 387
VAL A 405
SER A 475
VAL A 463
 None
 1.46A 1uofA-5cykA:
undetectable		 1uofA-5cykA:
21.76
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.
5deu METHYLCYTOSINE
DIOXYGENASE TET2,
CHIMERIC CONSTRUCT

(Homo sapiens) 		PF12851
(Tet_JBP) 		5 HIS A1382
ASP A1384
ARG A1896
SER A1898
VAL A1900
 FE  A2003 (-3.3A)
FE  A2003 ( 2.4A)
OGA  A2001 (-2.9A)
OGA  A2001 (-2.7A)
OGA  A2001 ( 4.9A)
 1.00A 1uofA-5deuA:
7.1		 1uofA-5deuA:
21.54
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.
5deu METHYLCYTOSINE
DIOXYGENASE TET2,
CHIMERIC CONSTRUCT

(Homo sapiens) 		PF12851
(Tet_JBP) 		5 HIS A1382
ASP A1384
HIS A1881
SER A1898
VAL A1900
 FE  A2003 (-3.3A)
FE  A2003 ( 2.4A)
FE  A2003 ( 3.2A)
OGA  A2001 (-2.7A)
OGA  A2001 ( 4.9A)
 0.79A 1uofA-5deuA:
7.1		 1uofA-5deuA:
21.54
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.
5deu METHYLCYTOSINE
DIOXYGENASE TET2,
CHIMERIC CONSTRUCT

(Homo sapiens) 		PF12851
(Tet_JBP) 		5 HIS A1382
THR A1393
HIS A1881
SER A1898
VAL A1900
 FE  A2003 (-3.3A)
CL  A2007 (-4.5A)
FE  A2003 ( 3.2A)
OGA  A2001 (-2.7A)
OGA  A2001 ( 4.9A)
 0.74A 1uofA-5deuA:
7.1		 1uofA-5deuA:
21.54
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.
5gja 1-AMINOCYCLOPROPANE-
1-CARBOXYLATE
OXIDASE 2

(Arabidopsis
thaliana) 		PF03171
(2OG-FeII_Oxy)
PF14226
(DIOX_N) 		5 HIS A 180
ASP A 182
HIS A 237
VAL A 239
SER A 163
 ZN  A 401 ( 3.4A)
ZN  A 401 ( 2.2A)
ZN  A 401 ( 3.3A)
None
None
 1.13A 1uofA-5gjaA:
20.6		 1uofA-5gjaA:
22.16
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.
5htf FOLDASE PROTEIN PRSA
1

(Listeria
monocytogenes) 		PF13616
(Rotamase_3) 		5 PHE A 164
ASP A 193
THR A 195
SER A 210
VAL A 213
 None
MPD  A 401 ( 4.3A)
None
None
None
 1.43A 1uofA-5htfA:
undetectable		 1uofA-5htfA:
21.15
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.
5jz8 ASPARTYL/ASPARAGINYL
BETA-HYDROXYLASE

(Homo sapiens) 		PF05118
(Asp_Arg_Hydrox)
PF13181
(TPR_8)
PF13432
(TPR_16) 		5 HIS A 679
HIS A 725
VAL A 727
ARG A 735
SER A 668
 MN  A 801 ( 3.4A)
MN  A 801 ( 3.4A)
OGA  A 802 ( 4.9A)
OGA  A 802 (-2.2A)
OGA  A 802 (-2.5A)
 1.18A 1uofA-5jz8A:
6.9		 1uofA-5jz8A:
20.18
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.
5o9w THEBAINE
6-O-DEMETHYLASE

(Papaver
somniferum) 		no annotation 5 HIS A 238
ASP A 240
THR A 245
ARG A 305
SER A 307
 NI  A 401 ( 3.3A)
NI  A 401 ( 2.5A)
None
AKG  A 402 (-2.7A)
AKG  A 402 (-2.5A)
 1.04A 1uofA-5o9wA:
21.4		 1uofA-5o9wA:
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.
5o9w THEBAINE
6-O-DEMETHYLASE

(Papaver
somniferum) 		no annotation 5 HIS A 238
ASP A 240
THR A 245
HIS A 295
SER A 307
 NI  A 401 ( 3.3A)
NI  A 401 ( 2.5A)
None
NI  A 401 ( 3.3A)
AKG  A 402 (-2.5A)
 0.64A 1uofA-5o9wA:
21.4		 1uofA-5o9wA:
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.
5v1b EGL NINE HOMOLOG 2

(Homo sapiens) 		PF13640
(2OG-FeII_Oxy_3) 		5 HIS A 297
ASP A 299
HIS A 358
VAL A 360
ARG A 367
 FE  A 503 ( 3.6A)
FE  A 503 (-2.7A)
FE  A 503 ( 3.5A)
8UY  A 504 (-4.8A)
8UY  A 504 (-4.1A)
 1.23A 1uofA-5v1bA:
10.7		 1uofA-5v1bA:
21.36
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.
5v1b EGL NINE HOMOLOG 2

(Homo sapiens) 		PF13640
(2OG-FeII_Oxy_3) 		5 HIS A 297
ASP A 299
THR A 309
HIS A 358
VAL A 360
 FE  A 503 ( 3.6A)
FE  A 503 (-2.7A)
None
FE  A 503 ( 3.5A)
8UY  A 504 (-4.8A)
 0.57A 1uofA-5v1bA:
10.7		 1uofA-5v1bA:
21.36
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.
5xoi OXIDOREDUCTASE,
2OG-FE OXYGENASE
FAMILY PROTEIN,
PUTATIVE, EXPRESSED

(Oryza sativa) 		no annotation 6 HIS A 279
ASP A 281
HIS A 339
VAL A 341
ARG A 363
SER A 299
 MN  A 402 ( 3.4A)
MN  A 402 (-2.5A)
MN  A 402 ( 3.4A)
None
SIN  A 401 (-2.8A)
None
 1.49A 1uofA-5xoiA:
6.9		 1uofA-5xoiA:
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.
6ax6 PROCOLLAGEN LYSYL
HYDROXYLASE AND
GLYCOSYLTRANSFERASE

(Acanthamoeba
polyphaga
mimivirus) 		no annotation 6 HIS A 825
ASP A 827
THR A 832
HIS A 877
ARG A 887
VAL A 891
 FE2  A 934 (-3.6A)
FE2  A 934 ( 2.8A)
None
FE2  A 934 (-3.5A)
IOD  A 923 (-3.4A)
None
 0.75A 1uofA-6ax6A:
8.3		 1uofA-6ax6A:
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.
6b20 GUANINE
NUCLEOTIDE-BINDING
PROTEIN
G(I)/G(S)/G(T)
SUBUNIT BETA-1

(Bos taurus) 		no annotation 5 ASP A 163
HIS A 142
VAL A 158
SER A 201
VAL A 187
 None
 1.46A 1uofA-6b20A:
undetectable		 1uofA-6b20A:
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.
6dch SCOE PROTEIN

(Streptomyces
coeruleorubidus) 		no annotation 5 HIS A 132
ASP A 134
THR A 145
HIS A 295
SER A 308
 ZN  A 403 (-3.2A)
ZN  A 403 (-2.4A)
None
ZN  A 403 ( 3.2A)
None
 1.02A 1uofA-6dchA:
5.5		 1uofA-6dchA:
undetectable