SIMILAR PATTERNS OF AMINO ACIDS FOR 3AXT_A_SAMA397

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.
1b9o PROTEIN
(ALPHA-LACTALBUMIN)

(Homo sapiens) 		PF00062
(Lys) 		5 LEU A  52
ILE A  41
ASP A  88
ILE A  89
ASP A  37
 None
None
CA  A 124 (-3.1A)
None
None
 1.11A 3axtA-1b9oA:
undetectable		 3axtA-1b9oA:
16.06
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.
1di0 LUMAZINE SYNTHASE

(Brucella
abortus) 		PF00885
(DMRL_synthase) 		5 ALA A  78
ARG A  31
SER A 113
ALA A 140
PHE A 132
 None
 1.16A 3axtA-1di0A:
undetectable		 3axtA-1di0A:
18.27
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.
1dul SIGNAL RECOGNITION
PARTICLE PROTEIN
(FIFTY-FOUR HOMOLOG)

(Escherichia
coli) 		PF02978
(SRP_SPB) 		5 ARG A  50
ALA A  41
ILE A  45
ASP A   2
GLU A   8
 A  B 140 ( 3.2A)
None
None
None
None
 1.16A 3axtA-1dulA:
undetectable		 3axtA-1dulA:
12.32
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.
1hml ALPHA-LACTALBUMIN

(Homo sapiens) 		PF00062
(Lys) 		5 LEU A  52
ILE A  41
ASP A  88
ILE A  89
ASP A  37
 None
None
CA  A 124 ( 3.2A)
None
None
 1.07A 3axtA-1hmlA:
undetectable		 3axtA-1hmlA:
15.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1psq PROBABLE THIOL
PEROXIDASE

(Streptococcus
pneumoniae) 		PF08534
(Redoxin) 		5 LEU A  72
ALA A  70
ILE A 157
ALA A 160
ASP A  73
 None
 1.09A 3axtA-1psqA:
2.0		 3axtA-1psqA:
18.21
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.
1pv9 XAA-PRO DIPEPTIDASE

(Pyrococcus
furiosus) 		PF00557
(Peptidase_M24)
PF01321
(Creatinase_N) 		5 LEU A 210
ALA A 177
ILE A 139
ALA A 143
ASP A 209
 None
None
None
None
ZN  A 402 (-2.2A)
 1.16A 3axtA-1pv9A:
undetectable		 3axtA-1pv9A:
24.88
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.
1r6u TRYPTOPHANYL-TRNA
SYNTHETASE

(Homo sapiens) 		PF00579
(tRNA-synt_1b) 		5 LEU A 403
ILE A 435
GLU A 436
ALA A 433
PHE A 406
 None
 1.21A 3axtA-1r6uA:
undetectable		 3axtA-1r6uA:
23.14
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.
1rqb TRANSCARBOXYLASE 5S
SUBUNIT

(Propionibacterium
freudenreichii) 		PF00682
(HMGL-like)
PF02436
(PYC_OADA) 		5 LEU A 214
ALA A 182
ILE A 198
ALA A 230
ASP A 239
 None
 1.04A 3axtA-1rqbA:
undetectable		 3axtA-1rqbA:
21.82
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.
1sfr ANTIGEN 85-A

(Mycobacterium
tuberculosis) 		PF00756
(Esterase) 		5 LEU A 278
ALA A 284
ARG A 280
SER A  33
ALA A 121
 None
 1.16A 3axtA-1sfrA:
undetectable		 3axtA-1sfrA:
20.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1t90 PROBABLE
METHYLMALONATE-SEMIA
LDEHYDE
DEHYDROGENASE

(Bacillus
subtilis) 		PF00171
(Aldedh) 		5 ALA A 403
ILE A 400
GLU A 382
ALA A 253
ASP A 430
 None
None
NAD  A1490 (-2.9A)
NAD  A1490 ( 4.7A)
None
 1.26A 3axtA-1t90A:
2.3		 3axtA-1t90A:
22.61
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.
1u08 HYPOTHETICAL
AMINOTRANSFERASE
YBDL

(Escherichia
coli) 		PF00155
(Aminotran_1_2) 		5 ALA A 228
ARG A 225
ILE A 197
ALA A 193
PHE A 185
 None
 1.21A 3axtA-1u08A:
5.2		 3axtA-1u08A:
20.70
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1uli BIPHENYL DIOXYGENASE
LARGE SUBUNIT

(Rhodococcus
jostii) 		PF00355
(Rieske)
PF00848
(Ring_hydroxyl_A) 		5 LEU A  33
ILE A  22
GLU A 425
ALA A 401
ASP A  34
 None
 1.25A 3axtA-1uliA:
undetectable		 3axtA-1uliA:
23.35
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.
1vrm HYPOTHETICAL PROTEIN
TM1553

(Thermotoga
maritima) 		PF02424
(ApbE) 		6 LEU A 198
ALA A 256
ILE A 294
ILE A 225
ALA A 201
ASP A 221
 None
None
None
None
None
UNL  A   4 (-2.5A)
 1.43A 3axtA-1vrmA:
undetectable		 3axtA-1vrmA:
22.50
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.
1wql IRON-SULFUR PROTEIN
LARGE SUBUNIT OF
CUMENE DIOXYGENASE

(Pseudomonas
fluorescens) 		PF00355
(Rieske)
PF00848
(Ring_hydroxyl_A) 		5 LEU A  36
ILE A  25
GLU A 435
ALA A 411
ASP A  37
 None
 1.23A 3axtA-1wqlA:
undetectable		 3axtA-1wqlA:
25.20
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.
1wxx HYPOTHETICAL PROTEIN
TTHA1280

(Thermus
thermophilus) 		PF10672
(Methyltrans_SAM) 		5 ARG A 202
ASP A 238
SER A 240
ALA A 266
ASP A 286
 None
 0.54A 3axtA-1wxxA:
17.7		 3axtA-1wxxA:
24.27
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.
1wy2 XAA-PRO DIPEPTIDASE

(Pyrococcus
horikoshii) 		PF00557
(Peptidase_M24)
PF01321
(Creatinase_N) 		5 LEU A 213
ALA A 180
ILE A 142
ALA A 146
ASP A 212
 None
None
None
None
ZN  A 405 ( 2.0A)
 1.20A 3axtA-1wy2A:
undetectable		 3axtA-1wy2A:
24.76
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.
2as0 HYPOTHETICAL PROTEIN
PH1915

(Pyrococcus
horikoshii) 		PF01472
(PUA)
PF10672
(Methyltrans_SAM) 		5 ARG A 208
ASP A 247
SER A 249
ALA A 276
ASP A 296
 None
 0.59A 3axtA-2as0A:
20.0		 3axtA-2as0A:
23.02
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.
2buy PROTOCATECHUATE
3,4-DIOXYGENASE
ALPHA CHAIN

(Acinetobacter
sp. ADP1) 		PF00775
(Dioxygenase_C) 		5 LEU A  63
ARG A  64
ILE A 130
ALA A 132
PHE A  56
 None
 1.19A 3axtA-2buyA:
undetectable		 3axtA-2buyA:
17.81
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.
2cn3 BETA-1,4-XYLOGLUCAN
HYDROLASE

(Ruminiclostridium
thermocellum) 		PF02012
(BNR) 		5 ALA A 118
ILE A 132
GLU A 459
ALA A  69
PHE A  91
 None
None
GLC  A1769 ( 4.6A)
None
None
 1.26A 3axtA-2cn3A:
undetectable		 3axtA-2cn3A:
19.44
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.
2ctz O-ACETYL-L-HOMOSERIN
E SULFHYDRYLASE

(Thermus
thermophilus) 		PF01053
(Cys_Met_Meta_PP) 		5 ARG A 327
ILE A 160
ILE A 178
ALA A 198
PHE A 137
 None
 1.20A 3axtA-2ctzA:
3.7		 3axtA-2ctzA:
24.79
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2dul N(2),N(2)-DIMETHYLGU
ANOSINE TRNA
METHYLTRANSFERASE

(Pyrococcus
horikoshii) 		PF02005
(TRM) 		10 ARG A  36
LEU A  55
ALA A  57
ILE A  60
ARG A  61
ASP A  78
ILE A  79
SER A  80
ALA A 121
ASP A 138
 None
 0.55A 3axtA-2dulA:
44.0		 3axtA-2dulA:
38.52
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2dul N(2),N(2)-DIMETHYLGU
ANOSINE TRNA
METHYLTRANSFERASE

(Pyrococcus
horikoshii) 		PF02005
(TRM) 		9 ARG A  36
LEU A  55
ALA A  57
ILE A  60
ARG A  61
SER A  80
ALA A 121
ASP A 138
PHE A 140
 None
 0.75A 3axtA-2dulA:
44.0		 3axtA-2dulA:
38.52
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2dul N(2),N(2)-DIMETHYLGU
ANOSINE TRNA
METHYLTRANSFERASE

(Pyrococcus
horikoshii) 		PF02005
(TRM) 		5 ILE A  63
ASP A  78
ILE A  79
SER A  80
ALA A 121
 None
 0.94A 3axtA-2dulA:
44.0		 3axtA-2dulA:
38.52
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.
2f57 SERINE/THREONINE-PRO
TEIN KINASE PAK 7

(Homo sapiens) 		PF00069
(Pkinase) 		5 ARG A 674
LEU A 679
GLU A 693
ALA A 689
ASP A 678
 None
 1.23A 3axtA-2f57A:
undetectable		 3axtA-2f57A:
21.81
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.
2fqd BLUE COPPER OXIDASE
CUEO

(Escherichia
coli) 		PF00394
(Cu-oxidase)
PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3) 		5 ARG A 232
ILE A 324
SER A 325
ALA A 226
ASP A 180
 None
 1.22A 3axtA-2fqdA:
undetectable		 3axtA-2fqdA:
18.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2fuk XC6422 PROTEIN

(Xanthomonas
campestris) 		PF12146
(Hydrolase_4) 		5 ALA A 141
ILE A 168
ILE A 138
SER A 139
ALA A  61
 None
 1.17A 3axtA-2fukA:
undetectable		 3axtA-2fukA:
21.33
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.
2fvm DIHYDROPYRIMIDINASE

(Lachancea
kluyveri) 		PF01979
(Amidohydro_1) 		5 ARG A 520
ALA A  61
ASP A  60
ALA A  82
PHE A  97
 None
None
None
None
KCX  A 167 ( 4.5A)
 1.03A 3axtA-2fvmA:
2.5		 3axtA-2fvmA:
21.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2k8s THIOREDOXIN

(Nitrosomonas
europaea) 		PF13192
(Thioredoxin_3) 		5 ALA A  65
ILE A  61
ILE A  74
SER A  55
GLU A  49
 None
 1.19A 3axtA-2k8sA:
undetectable		 3axtA-2k8sA:
12.34
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.
2krr NUCLEOLIN

(Homo sapiens) 		PF00076
(RRM_1) 		5 LEU A  96
ALA A  98
ILE A 132
GLU A 144
PHE A 114
 None
 1.14A 3axtA-2krrA:
undetectable		 3axtA-2krrA:
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.
2oby PUTATIVE QUINONE
OXIDOREDUCTASE

(Homo sapiens) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		5 ALA A  38
ILE A 326
SER A  66
ALA A  96
ASP A  43
 None
 1.21A 3axtA-2obyA:
7.4		 3axtA-2obyA:
22.93
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.
2r14 MORPHINONE REDUCTASE

(Pseudomonas
putida) 		PF00724
(Oxidored_FMN) 		5 ALA A 257
ILE A 212
ALA A 188
ASP A 250
PHE A 242
 None
 1.21A 3axtA-2r14A:
undetectable		 3axtA-2r14A:
21.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2vbk TAILSPIKE-PROTEIN

(Shigella virus
Sf6) 		PF12708
(Pectate_lyase_3) 		5 LEU A 398
ALA A 423
ILE A 435
SER A 467
ASP A 397
 None
 1.19A 3axtA-2vbkA:
undetectable		 3axtA-2vbkA:
19.89
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.
2xf8 D-ERYTHROSE-4-PHOSPH
ATE DEHYDROGENASE

(Escherichia
coli) 		PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C) 		5 LEU A 242
ILE A 228
ILE A 167
SER A 169
ASP A 241
 None
 1.04A 3axtA-2xf8A:
3.9		 3axtA-2xf8A:
22.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2xvn ASPERGILLUS
FUMIGATUS CHITINASE
A1

(Aspergillus
fumigatus) 		PF00704
(Glyco_hydro_18) 		5 ALA A 205
ILE A 229
ILE A 121
SER A 120
ASP A 212
 KLS  A1338 ( 4.3A)
None
None
None
None
 1.13A 3axtA-2xvnA:
undetectable		 3axtA-2xvnA:
21.08
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.
2ygk NURA

(Sulfolobus
solfataricus) 		PF09376
(NurA) 		5 ILE A  57
ILE A 108
SER A 109
ALA A  73
ASP A  92
 None
 1.19A 3axtA-2ygkA:
undetectable		 3axtA-2ygkA:
22.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2yia RNA-DIRECTED RNA
POLYMERASE

(Infectious
pancreatic
necrosis virus) 		PF04197
(Birna_RdRp) 		5 LEU A 200
ILE A 207
ILE A 486
GLU A 490
ALA A 489
 None
 1.14A 3axtA-2yiaA:
undetectable		 3axtA-2yiaA:
17.48
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.
3ai9 UPF0217 PROTEIN
MJ1640

(Methanocaldococcus
jannaschii) 		PF04013
(Methyltrn_RNA_2) 		5 LEU X 169
ARG X 120
ASP X 170
ALA X 174
ASP X 165
 None
 1.17A 3axtA-3ai9X:
undetectable		 3axtA-3ai9X:
23.53
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3axs PROBABLE
N(2),N(2)-DIMETHYLGU
ANOSINE TRNA
METHYLTRANSFERASE
TRM1

(Aquifex
aeolicus) 		PF02005
(TRM) 		12 ARG A  36
LEU A  60
ALA A  62
ILE A  65
ARG A  66
ASP A  84
ILE A  85
SER A  86
GLU A 113
ALA A 114
ASP A 132
PHE A 134
 SFG  A 501 (-4.2A)
SFG  A 501 (-3.7A)
SFG  A 501 (-3.4A)
None
SFG  A 501 (-4.3A)
SFG  A 501 (-2.8A)
SFG  A 501 (-3.7A)
SFG  A 501 ( 4.7A)
SFG  A 501 (-4.0A)
SFG  A 501 (-3.6A)
SFG  A 501 (-3.7A)
SFG  A 501 (-3.3A)
 0.20A 3axtA-3axsA:
66.8		 3axtA-3axsA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3axs PROBABLE
N(2),N(2)-DIMETHYLGU
ANOSINE TRNA
METHYLTRANSFERASE
TRM1

(Aquifex
aeolicus) 		PF02005
(TRM) 		5 ILE A  68
ASP A  84
ILE A  85
GLU A 113
ALA A 114
 None
SFG  A 501 (-2.8A)
SFG  A 501 (-3.7A)
SFG  A 501 (-4.0A)
SFG  A 501 (-3.6A)
 1.04A 3axtA-3axsA:
66.8		 3axtA-3axsA:
100.00
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.
3biw NEUROLIGIN-1

(Rattus
norvegicus) 		PF00135
(COesterase) 		5 LEU A 350
ALA A 244
SER A 239
ALA A 337
ASP A 346
 None
 1.04A 3axtA-3biwA:
undetectable		 3axtA-3biwA:
20.24
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ddu PROLYL ENDOPEPTIDASE

(Homo sapiens) 		PF00326
(Peptidase_S9)
PF02897
(Peptidase_S9_N) 		5 LEU A 634
ALA A 576
ILE A 550
ILE A 672
SER A 649
 None
 1.18A 3axtA-3dduA:
2.1		 3axtA-3dduA:
20.56
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.
3fz0 NUCLEOSIDE
HYDROLASE, PUTATIVE

(Trypanosoma
brucei) 		PF01156
(IU_nuc_hydro) 		5 LEU A 134
ALA A 138
ILE A 159
ALA A 130
ASP A 183
 None
 1.08A 3axtA-3fz0A:
4.2		 3axtA-3fz0A:
20.85
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.
3gzy BIPHENYL DIOXYGENASE
SUBUNIT ALPHA

(Comamonas
testosteroni) 		PF00355
(Rieske)
PF00848
(Ring_hydroxyl_A) 		5 LEU A  35
ILE A  24
GLU A 433
ALA A 409
ASP A  36
 None
 1.25A 3axtA-3gzyA:
undetectable		 3axtA-3gzyA:
23.11
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.
3h3e UNCHARACTERIZED
PROTEIN TM1679

(Thermotoga
maritima) 		PF00753
(Lactamase_B) 		5 LEU A 178
ALA A 124
ASP A 179
ALA A 181
ASP A 174
 None
 1.22A 3axtA-3h3eA:
undetectable		 3axtA-3h3eA:
23.50
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.
3hi8 PROLIFERATING CELL
NUCLEAR ANTIGEN PCNA

(Haloferax
volcanii) 		PF00705
(PCNA_N)
PF02747
(PCNA_C) 		5 LEU A  11
ALA A  82
ILE A 101
ALA A  77
ASP A  13
 None
 1.09A 3axtA-3hi8A:
undetectable		 3axtA-3hi8A:
19.34
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.
3hxw ALANYL-TRNA
SYNTHETASE

(Escherichia
coli) 		PF01411
(tRNA-synt_2c) 		5 LEU A 293
ALA A 291
ILE A 312
ASP A 296
PHE A  89
 None
 1.17A 3axtA-3hxwA:
undetectable		 3axtA-3hxwA:
22.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ilw DNA GYRASE SUBUNIT A

(Mycobacterium
tuberculosis) 		PF00521
(DNA_topoisoIV) 		5 LEU A 425
ALA A 432
ILE A 430
GLU A 403
ALA A 400
 None
 1.12A 3axtA-3ilwA:
undetectable		 3axtA-3ilwA:
20.29
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.
3lnp AMIDOHYDROLASE
FAMILY PROTEIN
OLEI01672_1_465

(Oleispira
antarctica) 		PF01979
(Amidohydro_1) 		5 LEU A 133
ALA A 136
ILE A 165
ILE A 450
ALA A 453
 None
 1.21A 3axtA-3lnpA:
2.6		 3axtA-3lnpA:
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.
3m70 TELLURITE RESISTANCE
PROTEIN TEHB HOMOLOG

(Haemophilus
influenzae) 		PF03848
(TehB)
PF09313
(DUF1971) 		5 ASP A 149
ILE A 155
SER A 154
ALA A 172
ASP A 175
 None
 1.21A 3axtA-3m70A:
13.0		 3axtA-3m70A:
19.95
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.
3o2r RIBONUCLEASE III

(Campylobacter
jejuni) 		PF14622
(Ribonucleas_3_3) 		5 LEU B  47
ARG B  71
ILE B  83
ALA B 135
ASP B  48
 None
 1.24A 3axtA-3o2rB:
undetectable		 3axtA-3o2rB:
19.54
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.
3pmq DECAHEME CYTOCHROME
C MTRF

(Shewanella
oneidensis) 		no annotation 5 LEU A 366
ARG A 367
SER A 356
ALA A 325
ASP A 365
 None
 1.07A 3axtA-3pmqA:
undetectable		 3axtA-3pmqA:
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.
3pz9 MANNAN
ENDO-1,4-BETA-MANNOS
IDASE. GLYCOSYL
HYDROLASE FAMILY 5

(Thermotoga
petrophila) 		PF00150
(Cellulase) 		5 ALA A 306
ILE A 303
SER A 268
ALA A 231
ASP A 345
 None
 1.13A 3axtA-3pz9A:
2.0		 3axtA-3pz9A:
20.55
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.
3qh6 CT296

(Chlamydia
trachomatis) 		PF16802
(DUF5070) 		5 LEU A 113
ALA A 143
ILE A 102
SER A 116
ALA A  25
 None
 1.08A 3axtA-3qh6A:
undetectable		 3axtA-3qh6A:
17.17
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.
3r13 DEOXYRIBOSE-PHOSPHAT
E ALDOLASE

(Thermotoga
maritima) 		PF01791
(DeoC) 		5 ALA A 209
ILE A 223
ILE A 152
SER A 181
ASP A 228
 None
 1.19A 3axtA-3r13A:
2.1		 3axtA-3r13A:
21.86
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.
3sgz HYDROXYACID OXIDASE
2

(Rattus
norvegicus) 		PF01070
(FMN_dh) 		5 ALA A 261
ILE A 259
ARG A 263
GLU A 232
ALA A 268
 None
 1.24A 3axtA-3sgzA:
undetectable		 3axtA-3sgzA:
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.
3two MANNITOL
DEHYDROGENASE

(Helicobacter
pylori) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		5 LEU A 188
ILE A 238
ILE A 163
SER A 167
ALA A 161
 NDP  A 601 (-3.5A)
None
None
None
None
 1.18A 3axtA-3twoA:
6.8		 3axtA-3twoA:
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.
3umm PHOSPHORIBOSYLFORMYL
GLYCINAMIDINE
SYNTHASE

(Salmonella
enterica) 		PF02769
(AIRS_C)
PF13507
(GATase_5) 		5 ARG A 700
LEU A 706
ALA A 710
ASP A 707
ALA A 621
 None
 1.17A 3axtA-3ummA:
undetectable		 3axtA-3ummA:
15.30
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.
3vgs NUCLEOSIDE
DIPHOSPHATE KINASE

(Halomonas sp.
#593) 		PF00334
(NDK) 		5 ALA A 115
ILE A  10
SER A 110
GLU A  97
ALA A  92
 None
 1.24A 3axtA-3vgsA:
undetectable		 3axtA-3vgsA:
16.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3zm8 GH26
ENDO-BETA-1,4-MANNAN
ASE

(Podospora
anserina) 		PF02156
(Glyco_hydro_26)
PF16990
(CBM_35) 		5 LEU A 271
ILE A 322
ASP A 275
SER A 198
PHE A 255
 None
 1.26A 3axtA-3zm8A:
undetectable		 3axtA-3zm8A:
21.97
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.
4dfe 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
SYNTHASE 3

(Paraburkholderia
xenovorans) 		PF08541
(ACP_syn_III_C)
PF08545
(ACP_syn_III) 		5 LEU A 240
ALA A 243
SER A 188
GLU A 314
ALA A 236
 None
 1.25A 3axtA-4dfeA:
undetectable		 3axtA-4dfeA:
21.13
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.
4eog PUTATIVE
UNCHARACTERIZED
PROTEIN

(Pyrococcus
furiosus) 		PF09455
(Cas_DxTHG) 		5 LEU A 410
ALA A 408
ILE A 402
SER A 403
ALA A 393
 None
 1.18A 3axtA-4eogA:
undetectable		 3axtA-4eogA:
23.05
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.
4goq HYPOTHETICAL PROTEIN

(Caulobacter
vibrioides) 		PF07372
(DUF1491) 		5 ARG A  27
ILE A  89
ILE A   7
SER A   4
ALA A  10
 None
None
None
GOL  A 201 (-3.6A)
None
 1.08A 3axtA-4goqA:
undetectable		 3axtA-4goqA:
15.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4h27 L-SERINE
DEHYDRATASE/L-THREON
INE DEAMINASE

(Homo sapiens) 		PF00291
(PALP) 		5 ALA A 273
ILE A 191
ILE A 255
GLU A 256
ALA A 253
 None
 1.15A 3axtA-4h27A:
4.4		 3axtA-4h27A:
22.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4hds ARSA

(Sporomusa ovata) 		PF02277
(DBI_PRT) 		5 ALA A  67
ILE A 132
ASP A  68
ILE A 179
ALA A  72
 None
 1.26A 3axtA-4hdsA:
undetectable		 3axtA-4hdsA:
23.24
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4hn8 D-GLUCARATE
DEHYDRATASE

(Pseudomonas
mendocina) 		PF13378
(MR_MLE_C) 		5 LEU A 400
ARG A 401
ASP A 362
ILE A 363
ALA A 366
 None
 1.26A 3axtA-4hn8A:
undetectable		 3axtA-4hn8A:
21.16
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.
4hts SEC-INDEPENDENT
PROTEIN TRANSLOCASE
PROTEIN TATC

(Aquifex
aeolicus) 		PF00902
(TatC) 		5 ALA A  70
ILE A  67
ILE A 162
GLU A 165
PHE A  21
 None
 1.24A 3axtA-4htsA:
undetectable		 3axtA-4htsA:
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.
4iil MEMBRANE LIPOPROTEIN
TPN38(B)

(Treponema
pallidum) 		PF02608
(Bmp) 		5 ALA A  67
ARG A  63
ILE A  53
ALA A  55
PHE A 101
 None
 1.18A 3axtA-4iilA:
undetectable		 3axtA-4iilA:
21.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4lj2 CHORISMATE SYNTHASE

(Acinetobacter
baumannii) 		PF01264
(Chorismate_synt) 		5 ALA A 211
ARG A 154
ILE A 245
GLU A 244
ALA A 289
 None
 1.22A 3axtA-4lj2A:
undetectable		 3axtA-4lj2A:
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.
4lmb CYSTEINE SYNTHASE

(Microcystis
aeruginosa) 		PF00291
(PALP) 		5 ARG A 301
LEU A 103
ALA A 107
ILE A  80
ARG A 105
 None
None
None
None
PLP  A 403 ( 4.9A)
 1.16A 3axtA-4lmbA:
3.4		 3axtA-4lmbA:
20.29
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.
4n5c CARGO-TRANSPORT
PROTEIN YPP1

(Saccharomyces
cerevisiae) 		no annotation 5 LEU A 198
ALA A 196
ARG A 199
ILE A 191
SER A 192
 None
 1.22A 3axtA-4n5cA:
undetectable		 3axtA-4n5cA:
18.66
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.
4nvt TRIOSEPHOSPHATE
ISOMERASE

(Brucella
melitensis) 		PF00121
(TIM) 		5 ARG A 208
ALA A  10
ILE A 165
SER A 238
ALA A 220
 None
 1.25A 3axtA-4nvtA:
undetectable		 3axtA-4nvtA:
19.46
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.
4r9o PUTATIVE ALDO/KETO
REDUCTASE

(Salmonella
enterica) 		PF00248
(Aldo_ket_red) 		5 LEU A  24
ARG A  23
GLU A  66
ALA A  63
PHE A  37
 None
 1.18A 3axtA-4r9oA:
undetectable		 3axtA-4r9oA:
22.14
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.
4r9o PUTATIVE ALDO/KETO
REDUCTASE

(Salmonella
enterica) 		PF00248
(Aldo_ket_red) 		5 LEU A  24
ILE A 260
GLU A  66
ALA A  63
PHE A  37
 None
 1.10A 3axtA-4r9oA:
undetectable		 3axtA-4r9oA:
22.14
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.
4rgg PUTATIVE PHAGE
STRUCTURAL PROTEIN

(Lactococcus
phage 1358) 		no annotation 5 ILE A 252
ARG A 378
ASP A 340
SER A 290
ALA A 296
 None
 1.19A 3axtA-4rggA:
undetectable		 3axtA-4rggA:
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.
4toq CLASS III CHITINASE

(Punica granatum) 		PF00704
(Glyco_hydro_18) 		5 ALA A 156
ILE A 180
ILE A  78
SER A  77
ASP A 163
 None
 1.14A 3axtA-4toqA:
undetectable		 3axtA-4toqA:
19.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4zr8 UROPORPHYRINOGEN
DECARBOXYLASE

(Acinetobacter
baumannii) 		PF01208
(URO-D) 		5 LEU A  10
ARG A  11
ILE A 243
ALA A 203
ASP A   7
 None
 1.13A 3axtA-4zr8A:
2.4		 3axtA-4zr8A:
24.49
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.
4zys EXOTOXIN 6

(Staphylococcus
aureus) 		PF02876
(Stap_Strp_tox_C)
PF09199
(SSL_OB) 		5 LEU A 159
ILE A 116
ASP A 163
ILE A 186
ASP A 211
 None
 1.23A 3axtA-4zysA:
undetectable		 3axtA-4zysA:
20.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5a8r METHYL-COENZYME M
REDUCTASE II SUBUNIT
ALPHA

(Methanothermobacter
marburgensis) 		PF02249
(MCR_alpha)
PF02745
(MCR_alpha_N) 		5 ALA A 290
ILE A 511
ILE A 310
SER A 306
ALA A 314
 None
 1.22A 3axtA-5a8rA:
undetectable		 3axtA-5a8rA:
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.
5aew BIPHENYL DIOXYGENASE
SUBUNIT ALPHA

(Paraburkholderia
xenovorans) 		PF00355
(Rieske)
PF00848
(Ring_hydroxyl_A) 		5 LEU A  35
ILE A  24
GLU A 435
ALA A 411
ASP A  36
 None
 1.19A 3axtA-5aewA:
undetectable		 3axtA-5aewA:
22.09
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.
5d9a RNA-DIRECTED RNA
POLYMERASE CATALYTIC
SUBUNIT

(Influenza C
virus) 		PF00602
(Flu_PB1) 		5 LEU B 148
ALA B 152
ILE B 181
ASP B 151
GLU B 682
 None
 1.16A 3axtA-5d9aB:
undetectable		 3axtA-5d9aB:
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.
5epg ALDEHYDE OXIDASE

(Homo sapiens) 		PF00111
(Fer2)
PF00941
(FAD_binding_5)
PF01315
(Ald_Xan_dh_C)
PF01799
(Fer2_2)
PF02738
(Ald_Xan_dh_C2)
PF03450
(CO_deh_flav_C) 		5 ALA A 160
ILE A 158
ARG A 155
GLU A 206
ALA A 203
 None
 1.19A 3axtA-5epgA:
undetectable		 3axtA-5epgA:
14.41
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.
5g5g PUTATIVE XANTHINE
DEHYDROGENASE YAGS
FAD-BINDING SUBUNIT

(Escherichia
coli) 		PF01315
(Ald_Xan_dh_C)
PF02738
(Ald_Xan_dh_C2) 		5 LEU C 405
ALA C 409
ARG C 406
GLU C 362
ALA C 437
 None
 1.25A 3axtA-5g5gC:
undetectable		 3axtA-5g5gC:
19.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5gjn LYSINE/ORNITHINE
DECARBOXYLASE

(Selenomonas
ruminantium) 		PF00278
(Orn_DAP_Arg_deC)
PF02784
(Orn_Arg_deC_N) 		5 ARG A 112
LEU A 214
ILE A  91
ALA A 197
ASP A 213
 PGE  A 406 (-3.9A)
None
None
None
PGE  A 406 (-3.8A)
 1.04A 3axtA-5gjnA:
2.1		 3axtA-5gjnA:
23.98
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.
5gll GLYCOSIDE HYDROLASE
FAMILY 43

(uncultured
bacterium) 		PF04616
(Glyco_hydro_43) 		5 ALA A 269
ILE A 176
ILE A 322
ALA A  60
ASP A  57
 CA  A 401 ( 4.9A)
None
None
None
GOL  A 403 (-2.9A)
 1.15A 3axtA-5gllA:
undetectable		 3axtA-5gllA:
22.17
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.
5h83 HETEROYOHIMBINE
SYNTHASE HYS

(Catharanthus
roseus) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		5 LEU A 192
ILE A 248
ILE A 166
SER A 170
ALA A 164
 None
 1.20A 3axtA-5h83A:
5.1		 3axtA-5h83A:
20.29
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.
5jjq AMP-DEPENDENT
SYNTHETASE AND
LIGASE

(Streptomyces
sp. ML694-90F3) 		PF00501
(AMP-binding)
PF13193
(AMP-binding_C) 		5 LEU A 144
ALA A  84
ILE A  82
ARG A  52
ALA A  59
 None
 1.26A 3axtA-5jjqA:
undetectable		 3axtA-5jjqA:
22.14
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.
5kku POLYKETIDE SYNTHASE
TYPE I

(Bacillus
amyloliquefaciens) 		PF14765
(PS-DH) 		5 ARG A 268
LEU A 177
ILE A 128
ILE A 144
ALA A 199
 None
 1.22A 3axtA-5kkuA:
undetectable		 3axtA-5kkuA:
20.20
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.
5koi ENOYL-[ACYL-CARRIER-
PROTEIN] REDUCTASE
[NADH]

(Brucella
abortus) 		PF13561
(adh_short_C2) 		5 LEU A 174
ILE A 245
ILE A 183
SER A 141
GLU A 133
 None
 1.20A 3axtA-5koiA:
3.1		 3axtA-5koiA:
23.36
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.
5no4 30S RIBOSOMAL
PROTEIN S3

(Escherichia
coli) 		PF00189
(Ribosomal_S3_C)
PF07650
(KH_2) 		5 LEU C 115
ALA C 113
ASP C 112
ALA C  71
ASP C 118
 None
 1.25A 3axtA-5no4C:
undetectable		 3axtA-5no4C:
20.10
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.
5oe5 ANTHRANILATE--COA
LIGASE

(Pseudomonas
aeruginosa) 		PF00501
(AMP-binding) 		5 ARG A 393
ASP A 299
SER A 277
GLU A 296
ALA A 318
 None
3UK  A 900 (-2.6A)
None
None
None
 1.15A 3axtA-5oe5A:
undetectable		 3axtA-5oe5A:
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.
5oe5 ANTHRANILATE--COA
LIGASE

(Pseudomonas
aeruginosa) 		PF00501
(AMP-binding) 		5 ARG A 393
SER A 277
GLU A 296
ALA A 318
ASP A 321
 None
 1.14A 3axtA-5oe5A:
undetectable		 3axtA-5oe5A:
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.
5udb DNA REPLICATION
LICENSING FACTOR
MCM2

(Saccharomyces
cerevisiae) 		PF00493
(MCM)
PF14551
(MCM_N)
PF17207
(MCM_OB) 		5 ARG 2 836
ILE 2 494
ILE 2 755
SER 2 756
ALA 2 502
 None
 1.09A 3axtA-5udb2:
undetectable		 3axtA-5udb2:
18.03
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.
5vf4 UNCHARACTERIZED
PROTEIN

(Thermus
aquaticus) 		PF03781
(FGE-sulfatase) 		5 ALA A 378
ILE A  67
ILE A  82
SER A  83
GLU A  80
 None
 1.24A 3axtA-5vf4A:
undetectable		 3axtA-5vf4A:
21.62
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.
5xge UNCHARACTERIZED
PROTEIN PA0861

(Pseudomonas
aeruginosa) 		no annotation 5 ARG A 531
LEU A 500
ALA A 520
SER A 516
ALA A 407
 None
 1.25A 3axtA-5xgeA:
undetectable		 3axtA-5xgeA:
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.
5xtb NADH-UBIQUINONE
OXIDOREDUCTASE 75
KDA SUBUNIT,
MITOCHONDRIAL

(Homo sapiens) 		PF00384
(Molybdopterin)
PF09326
(NADH_dhqG_C)
PF10588
(NADH-G_4Fe-4S_3)
PF13510
(Fer2_4) 		5 ALA M 322
ILE M 583
ILE M 629
GLU M 628
ALA M 625
 None
 1.10A 3axtA-5xtbM:
undetectable		 3axtA-5xtbM:
19.41
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.
5xtb NADH-UBIQUINONE
OXIDOREDUCTASE 75
KDA SUBUNIT,
MITOCHONDRIAL

(Homo sapiens) 		PF00384
(Molybdopterin)
PF09326
(NADH_dhqG_C)
PF10588
(NADH-G_4Fe-4S_3)
PF13510
(Fer2_4) 		5 ILE M 583
ILE M 629
SER M 324
GLU M 628
ALA M 625
 None
 1.09A 3axtA-5xtbM:
undetectable		 3axtA-5xtbM:
19.41
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.
5z0c NEROL DEHYDROGENASE

(Persicaria
minor) 		no annotation 5 LEU A 196
ILE A 252
ILE A 170
SER A 174
ALA A 168
 BME  A 405 (-3.9A)
None
None
None
None
 1.20A 3axtA-5z0cA:
6.2		 3axtA-5z0cA:
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.
6ccb GLYCOPROTEIN 41
GLYCOPROTEIN 120

(Human
immunodeficiency
virus 1;
Human
immunodeficiency
virus 1) 		no annotation
no annotation 		5 ILE C 491
ASP A 632
ILE A 635
SER A 636
ALA C 497
 None
 1.15A 3axtA-6ccbC:
undetectable		 3axtA-6ccbC:
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.
6f8y THREONYLCARBAMOYL-AM
P SYNTHASE

(Pyrococcus
abyssi) 		no annotation 5 LEU A 101
ALA A 119
ILE A 111
ILE A 184
ALA A  85
 None
 1.22A 3axtA-6f8yA:
2.2		 3axtA-6f8yA:
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.
6gww PEROXIREDOXIN

(Sulfolobus
islandicus) 		no annotation 5 ILE A   9
ARG A 137
ILE A  71
GLU A  69
ASP A 131
 None
 1.16A 3axtA-6gwwA:
undetectable		 3axtA-6gwwA:
undetectable