SIMILAR PATTERNS OF AMINO ACIDS FOR 1ZQ9_B_SAMB4001

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.
1dmu BGLI RESTRICTION
ENDONUCLEASE

(Bacillus
subtilis) 		PF14562
(Endonuc_BglI) 		5 GLY A 243
LEU A 198
PRO A 208
ILE A 206
PHE A 140
 None
 0.92A 1zq9B-1dmuA:
undetectable		 1zq9B-1dmuA:
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.
1geg ACETOIN REDUCTASE

(Klebsiella
pneumoniae) 		PF00106
(adh_short) 		5 GLY A   9
GLY A  11
ASP A  59
VAL A  60
ILE A 109
 NAD  A2001 (-3.5A)
NAD  A2001 ( 4.1A)
NAD  A2001 (-3.6A)
NAD  A2001 (-3.5A)
NAD  A2001 (-3.8A)
 0.85A 1zq9B-1gegA:
5.7		 1zq9B-1gegA:
23.70
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.
1gq1 CYTOCHROME CD1
NITRITE REDUCTASE

(Paracoccus
pantotrophus) 		PF02239
(Cytochrom_D1)
PF13442
(Cytochrome_CBB3) 		5 LEU A 541
VAL A 534
LEU A 490
PRO A 491
ILE A 492
 None
 0.93A 1zq9B-1gq1A:
undetectable		 1zq9B-1gq1A:
18.29
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.
1iy8 LEVODIONE REDUCTASE

(Leifsonia
aquatica) 		PF13561
(adh_short_C2) 		5 GLY A  20
GLY A  22
ASP A  72
VAL A  73
ILE A 123
 NAD  A1268 (-3.4A)
NAD  A1268 ( 4.1A)
NAD  A1268 (-3.5A)
NAD  A1268 (-3.5A)
NAD  A1268 ( 3.9A)
 0.88A 1zq9B-1iy8A:
6.4		 1zq9B-1iy8A:
23.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1pxt PEROXISOMAL
3-KETOACYL-COA
THIOLASE

(Saccharomyces
cerevisiae) 		PF00108
(Thiolase_N)
PF02803
(Thiolase_C) 		5 GLY A 128
GLY A 378
LEU A 150
VAL A 283
ILE A 135
 None
 0.95A 1zq9B-1pxtA:
undetectable		 1zq9B-1pxtA:
20.05
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.
1qyr HIGH LEVEL
KASUGAMYCIN
RESISTANCE PROTEIN

(Escherichia
coli) 		PF00398
(RrnaAD) 		7 GLY A  45
GLY A  47
ASN A 113
LEU A 114
PRO A 115
ILE A 118
PHE A 181
 None
 1.16A 1zq9B-1qyrA:
26.6		 1zq9B-1qyrA:
28.32
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.
1qyr HIGH LEVEL
KASUGAMYCIN
RESISTANCE PROTEIN

(Escherichia
coli) 		PF00398
(RrnaAD) 		9 GLY A  45
GLY A  47
LEU A  67
LEU A  71
ASP A  91
ASN A 113
PRO A 115
ILE A 118
PHE A 181
 None
 0.80A 1zq9B-1qyrA:
26.6		 1zq9B-1qyrA:
28.32
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.
1qyr HIGH LEVEL
KASUGAMYCIN
RESISTANCE PROTEIN

(Escherichia
coli) 		PF00398
(RrnaAD) 		6 GLY A 112
ASN A 113
LEU A 114
PRO A 115
ILE A 118
PHE A 181
 None
 1.21A 1zq9B-1qyrA:
26.6		 1zq9B-1qyrA:
28.32
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.
1vdc NADPH DEPENDENT
THIOREDOXIN
REDUCTASE

(Arabidopsis
thaliana) 		PF07992
(Pyr_redox_2) 		5 HIS A  18
GLY A 285
GLY A 302
LEU A 110
PHE A  68
 None
FAD  A 400 ( 3.2A)
None
None
None
 0.95A 1zq9B-1vdcA:
4.7		 1zq9B-1vdcA:
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.
1w8d 2,4-DIENOYL-COA
REDUCTASE,
MITOCHONDRIAL
PRECURSOR

(Homo sapiens) 		PF13561
(adh_short_C2) 		5 GLY A  66
GLY A  68
ASP A 117
VAL A 118
ILE A 167
 NAP  A1330 (-3.5A)
None
NAP  A1330 (-3.2A)
NAP  A1330 (-3.5A)
NAP  A1330 (-4.1A)
 0.79A 1zq9B-1w8dA:
5.8		 1zq9B-1w8dA:
23.62
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.
1wv9 RHODANESE HOMOLOG
TT1651

(Thermus
thermophilus) 		no annotation 5 GLY A  63
GLY A  86
LEU A  58
LEU A  83
VAL A  68
 None
 1.02A 1zq9B-1wv9A:
undetectable		 1zq9B-1wv9A:
16.23
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.
1wy7 HYPOTHETICAL PROTEIN
PH1948

(Pyrococcus
horikoshii) 		PF05175
(MTS) 		6 GLY A  57
GLY A  59
ASP A 105
VAL A 106
ASN A 119
PRO A 121
 SAH  A1001 (-3.4A)
SAH  A1001 (-3.3A)
SAH  A1001 (-3.2A)
SAH  A1001 (-3.9A)
SAH  A1001 (-4.6A)
None
 1.06A 1zq9B-1wy7A:
14.8		 1zq9B-1wy7A:
22.41
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.
1zem XYLITOL
DEHYDROGENASE

(Gluconobacter
oxydans) 		PF13561
(adh_short_C2) 		5 GLY A  14
GLY A  16
ASP A  64
VAL A  65
ILE A 115
 NAD  A2263 (-3.2A)
NAD  A2263 (-3.9A)
NAD  A2263 (-3.7A)
NAD  A2263 (-3.6A)
NAD  A2263 (-4.3A)
 0.77A 1zq9B-1zemA:
6.3		 1zq9B-1zemA:
22.11
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.
1zit TRANSCRIPTIONAL
REGULATOR (NTRC
FAMILY)

(Aquifex
aeolicus) 		PF00072
(Response_reg) 		5 GLY A  60
GLY A  58
VAL A  78
ASN A  62
ILE A  67
 None
 0.89A 1zq9B-1zitA:
undetectable		 1zq9B-1zitA:
18.62
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1zq9 PROBABLE
DIMETHYLADENOSINE
TRANSFERASE

(Homo sapiens) 		PF00398
(RrnaAD) 		11 HIS A  37
GLY A  64
GLY A  66
LEU A  86
LEU A  90
ASP A 113
VAL A 114
ASN A 128
PRO A 130
ILE A 133
PHE A 196
 SAM  A4000 (-4.9A)
SAM  A4000 (-3.1A)
SAM  A4000 (-3.2A)
SAM  A4000 (-3.7A)
SAM  A4000 (-4.8A)
SAM  A4000 (-3.8A)
SAM  A4000 (-3.9A)
SAM  A4000 (-2.7A)
SAM  A4000 (-4.1A)
SAM  A4000 ( 4.5A)
SAM  A4000 (-3.9A)
 0.40A 1zq9B-1zq9A:
40.2		 1zq9B-1zq9A:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1zq9 PROBABLE
DIMETHYLADENOSINE
TRANSFERASE

(Homo sapiens) 		PF00398
(RrnaAD) 		10 HIS A  37
GLY A  64
GLY A  66
LEU A  90
VAL A 114
ASN A 128
LEU A 129
PRO A 130
ILE A 133
PHE A 196
 SAM  A4000 (-4.9A)
SAM  A4000 (-3.1A)
SAM  A4000 (-3.2A)
SAM  A4000 (-4.8A)
SAM  A4000 (-3.9A)
SAM  A4000 (-2.7A)
None
SAM  A4000 (-4.1A)
SAM  A4000 ( 4.5A)
SAM  A4000 (-3.9A)
 0.67A 1zq9B-1zq9A:
40.2		 1zq9B-1zq9A:
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.
2b3t PROTEIN
METHYLTRANSFERASE
HEMK

(Escherichia
coli) 		PF13847
(Methyltransf_31) 		5 GLY A 117
GLY A 119
ASP A 167
ASN A 183
PRO A 185
 SAH  A 300 (-3.4A)
SAH  A 300 (-3.5A)
SAH  A 300 (-3.0A)
SAH  A 300 (-3.9A)
SAH  A 300 ( 3.9A)
 0.97A 1zq9B-2b3tA:
12.4		 1zq9B-2b3tA:
24.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2cvo PUTATIVE
SEMIALDEHYDE
DEHYDROGENASE

(Oryza sativa) 		PF01118
(Semialdhyde_dh)
PF02774
(Semialdhyde_dhC) 		5 GLY A  79
GLY A  82
VAL A 131
LEU A 146
PRO A 147
 CSO  A 145 ( 3.2A)
None
None
CSO  A 145 ( 3.5A)
None
 0.86A 1zq9B-2cvoA:
4.1		 1zq9B-2cvoA:
21.09
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.
2eh6 ACETYLORNITHINE
AMINOTRANSFERASE

(Aquifex
aeolicus) 		PF00202
(Aminotran_3) 		6 GLY A 318
GLY A 316
VAL A 298
LEU A 319
PRO A 355
ILE A 359
 None
 1.23A 1zq9B-2eh6A:
undetectable		 1zq9B-2eh6A:
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.
2ewm (S)-1-PHENYLETHANOL
DEHYDROGENASE

(Azoarcus) 		PF13561
(adh_short_C2) 		5 GLY A  14
LEU A  39
ASP A  62
VAL A  63
ILE A 112
 NAD  A 257 (-3.3A)
NAD  A 257 (-4.1A)
NAD  A 257 (-3.5A)
NAD  A 257 (-3.4A)
NAD  A 257 ( 4.3A)
 0.69A 1zq9B-2ewmA:
2.5		 1zq9B-2ewmA:
24.12
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2h1r DIMETHYLADENOSINE
TRANSFERASE,
PUTATIVE

(Plasmodium
falciparum) 		PF00398
(RrnaAD) 		6 GLY A  29
GLY A  31
ASN A  92
PRO A  94
ILE A  97
PHE A 160
 None
 0.75A 1zq9B-2h1rA:
33.7		 1zq9B-2h1rA:
44.97
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.
2nyp BETA-LACTAMASE II

(Bacillus cereus) 		PF00753
(Lactamase_B) 		5 GLY A 166
GLY A 209
VAL A 196
LEU A 164
ILE A 203
 None
ZN  A 302 ( 4.8A)
None
None
None
 0.98A 1zq9B-2nypA:
undetectable		 1zq9B-2nypA:
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.
2ppl PANCREATIC
LIPASE-RELATED
PROTEIN 1

(Homo sapiens) 		PF00151
(Lipase)
PF01477
(PLAT) 		5 GLY A 169
GLY A 192
VAL A 105
ILE A  97
PHE A 200
 None
 0.98A 1zq9B-2pplA:
undetectable		 1zq9B-2pplA:
20.42
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.
2qq5 DEHYDROGENASE/REDUCT
ASE SDR FAMILY
MEMBER 1

(Homo sapiens) 		PF00106
(adh_short) 		5 HIS A 184
GLY A 144
LEU A 137
ASP A  79
PRO A 140
 None
 0.96A 1zq9B-2qq5A:
5.2		 1zq9B-2qq5A:
19.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2vd3 ATP
PHOSPHORIBOSYLTRANSF
ERASE

(Methanothermobacter
thermautotrophicus) 		PF01634
(HisG)
PF08029
(HisG_C) 		5 GLY A 204
GLY A 207
VAL A  26
LEU A 201
ILE A   5
 None
 0.98A 1zq9B-2vd3A:
undetectable		 1zq9B-2vd3A:
22.29
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.
2ynm LIGHT-INDEPENDENT
PROTOCHLOROPHYLLIDE
REDUCTASE SUBUNIT N

(Prochlorococcus
marinus) 		PF00148
(Oxidored_nitro) 		5 GLY C  38
LEU C  65
ASP C  81
VAL C  84
LEU C  99
 None
 0.94A 1zq9B-2ynmC:
undetectable		 1zq9B-2ynmC:
22.90
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.
3a18 ALDOXIME DEHYDRATASE

(Rhodococcus
erythropolis) 		PF13816
(Dehydratase_hem) 		5 HIS A 320
GLY A 154
GLY A 156
VAL A  96
ILE A 280
 BXO  A 355 (-3.8A)
None
None
None
None
 0.99A 1zq9B-3a18A:
undetectable		 1zq9B-3a18A:
19.84
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.
3aeu LIGHT-INDEPENDENT
PROTOCHLOROPHYLLIDE
REDUCTASE SUBUNIT N

(Rhodobacter
capsulatus) 		PF00148
(Oxidored_nitro) 		5 GLY A  47
LEU A  74
ASP A  90
VAL A  93
LEU A 108
 None
 0.93A 1zq9B-3aeuA:
undetectable		 1zq9B-3aeuA:
23.93
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.
3b89 16S RRNA METHYLASE

(Escherichia
coli) 		PF07091
(FmrO) 		5 GLY A 113
LEU A 136
ASP A 157
VAL A 158
LEU A 175
 5GP  A 500 ( 4.5A)
None
5GP  A 500 (-2.7A)
5GP  A 500 (-3.6A)
5GP  A 500 ( 4.7A)
 0.86A 1zq9B-3b89A:
11.5		 1zq9B-3b89A:
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.
3c24 PUTATIVE
OXIDOREDUCTASE

(Jannaschia sp.
CCS1) 		PF03807
(F420_oxidored)
PF16896
(PGDH_C) 		5 GLY A  17
GLY A  19
LEU A  74
PRO A  75
ILE A  78
 None
 0.77A 1zq9B-3c24A:
4.7		 1zq9B-3c24A:
21.32
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3fut DIMETHYLADENOSINE
TRANSFERASE

(Thermus
thermophilus) 		PF00398
(RrnaAD) 		6 GLY A  54
GLY A  56
ASP A  99
ASN A 117
LEU A 118
PHE A 184
 None
 1.13A 1zq9B-3futA:
24.1		 1zq9B-3futA:
31.15
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3fut DIMETHYLADENOSINE
TRANSFERASE

(Thermus
thermophilus) 		PF00398
(RrnaAD) 		6 GLY A  54
GLY A  56
LEU A  80
ASP A  99
ASN A 117
PHE A 184
 None
 0.63A 1zq9B-3futA:
24.1		 1zq9B-3futA:
31.15
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3fyd PROBABLE
DIMETHYLADENOSINE
TRANSFERASE

(Methanocaldococcus
jannaschii) 		PF00398
(RrnaAD) 		7 GLY A  38
GLY A  40
LEU A  64
ASP A  84
ASN A 101
ILE A 106
PHE A 167
 None
 0.75A 1zq9B-3fydA:
28.0		 1zq9B-3fydA:
36.39
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3fyd PROBABLE
DIMETHYLADENOSINE
TRANSFERASE

(Methanocaldococcus
jannaschii) 		PF00398
(RrnaAD) 		7 GLY A  40
LEU A  64
ASP A  84
ASN A 101
PRO A 103
ILE A 106
PHE A 167
 None
 1.04A 1zq9B-3fydA:
28.0		 1zq9B-3fydA:
36.39
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3gry DIMETHYLADENOSINE
TRANSFERASE

(Methanocaldococcus
jannaschii) 		PF00398
(RrnaAD) 		7 GLY A  38
GLY A  40
LEU A  64
ASP A  84
ASN A 101
ILE A 106
PHE A 167
 SAM  A 300 (-3.3A)
SAM  A 300 (-3.3A)
SAM  A 300 (-4.8A)
SAM  A 300 (-3.7A)
SAM  A 300 (-3.6A)
SAM  A 300 ( 4.4A)
None
 0.82A 1zq9B-3gryA:
27.8		 1zq9B-3gryA:
35.74
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3gry DIMETHYLADENOSINE
TRANSFERASE

(Methanocaldococcus
jannaschii) 		PF00398
(RrnaAD) 		7 GLY A  40
LEU A  64
ASP A  84
ASN A 101
PRO A 103
ILE A 106
PHE A 167
 SAM  A 300 (-3.3A)
SAM  A 300 (-4.8A)
SAM  A 300 (-3.7A)
SAM  A 300 (-3.6A)
SAM  A 300 (-3.8A)
SAM  A 300 ( 4.4A)
None
 1.09A 1zq9B-3gryA:
27.8		 1zq9B-3gryA:
35.74
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3gy9 GCN5-RELATED
N-ACETYLTRANSFERASE

(Exiguobacterium
sibiricum) 		PF13673
(Acetyltransf_10) 		5 GLY A  93
GLY A  91
VAL A  81
LEU A  97
ILE A 100
 COA  A 201 (-3.4A)
COA  A 201 (-3.2A)
COA  A 201 (-4.3A)
None
None
 1.00A 1zq9B-3gy9A:
undetectable		 1zq9B-3gy9A:
16.26
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.
3hs8 ADAPTOR PROTEIN
COMPLEX AP-2, ALPHA
2 SUBUNIT

(Mus musculus) 		PF02296
(Alpha_adaptin_C)
PF02883
(Alpha_adaptinC2) 		5 GLY A 725
VAL A 787
LEU A 818
PRO A 819
ILE A 820
 None
 0.89A 1zq9B-3hs8A:
undetectable		 1zq9B-3hs8A:
20.62
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.
3j31 C381 TURRET PROTEIN

(Sulfolobus
turreted
icosahedral
virus 1) 		no annotation 5 HIS P 296
GLY P 292
VAL P 239
LEU P 230
ILE P 232
 None
 1.01A 1zq9B-3j31P:
undetectable		 1zq9B-3j31P:
21.45
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ju1 ENOYL-COA
HYDRATASE/ISOMERASE
FAMILY PROTEIN

(Shewanella
oneidensis) 		PF16113
(ECH_2) 		6 HIS A 189
GLY A  81
LEU A  41
VAL A  84
PRO A 156
ILE A 160
 None
 1.42A 1zq9B-3ju1A:
undetectable		 1zq9B-3ju1A:
23.23
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.
3l5o UNCHARACTERIZED
PROTEIN FROM DUF364
FAMILY

(Desulfitobacterium
hafniense) 		PF04016
(DUF364)
PF13938
(DUF4213) 		6 GLY A  39
VAL A 232
ASN A  83
LEU A  38
PRO A 201
ILE A 240
 None
None
None
None
EDO  A 307 ( 4.1A)
None
 1.38A 1zq9B-3l5oA:
4.9		 1zq9B-3l5oA:
23.55
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.
3lga SAM-DEPENDENT
METHYLTRANSFERASE

(Pyrococcus
abyssi) 		PF08704
(GCD14)
PF14801
(GCD14_N) 		5 GLY A 101
GLY A 103
ASP A 153
LEU A 170
PRO A 171
 SAH  A 301 (-3.1A)
SAH  A 301 (-3.5A)
SAH  A 301 (-3.1A)
SAH  A 301 (-4.2A)
SAH  A 301 (-4.8A)
 0.76A 1zq9B-3lgaA:
15.0		 1zq9B-3lgaA:
22.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3n5m ADENOSYLMETHIONINE-8
-AMINO-7-OXONONANOAT
E AMINOTRANSFERASE

(Bacillus
anthracis) 		PF00202
(Aminotran_3) 		5 GLY A 372
GLY A 370
LEU A 373
PRO A 426
ILE A 430
 None
 1.01A 1zq9B-3n5mA:
undetectable		 1zq9B-3n5mA:
19.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3q87 N6 ADENINE SPECIFIC
DNA METHYLASE

(Encephalitozoon
cuniculi) 		PF05175
(MTS) 		5 GLY B  31
LEU B  52
ASP B  69
ASN B  85
PRO B  87
 SAM  B 300 (-3.5A)
SAM  B 300 (-3.9A)
SAM  B 300 (-3.7A)
SAM  B 300 (-3.9A)
SAM  B 300 (-4.1A)
 0.77A 1zq9B-3q87B:
12.8		 1zq9B-3q87B:
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.
3qvo NMRA FAMILY PROTEIN

(Shigella
flexneri) 		PF13460
(NAD_binding_10) 		5 GLY A   8
GLY A  10
VAL A  54
ASN A  73
LEU A  74
 None
 0.70A 1zq9B-3qvoA:
6.0		 1zq9B-3qvoA:
23.47
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.
3ruy ORNITHINE
AMINOTRANSFERASE

(Bacillus
anthracis) 		PF00202
(Aminotran_3) 		6 GLY A 338
GLY A 336
LEU A 319
LEU A 339
PRO A 375
ILE A 379
 None
 1.23A 1zq9B-3ruyA:
undetectable		 1zq9B-3ruyA:
20.45
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3sb4 HYPOTHETICAL LEUCINE
RICH REPEAT PROTEIN

(Bacteroides
thetaiotaomicron) 		PF13306
(LRR_5) 		5 HIS A 279
LEU A 251
LEU A 277
PRO A 278
ILE A 261
 None
 1.02A 1zq9B-3sb4A:
2.5		 1zq9B-3sb4A:
21.70
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3tqs RIBOSOMAL RNA SMALL
SUBUNIT
METHYLTRANSFERASE A

(Coxiella
burnetii) 		PF00398
(RrnaAD) 		6 GLY A  40
GLY A  42
LEU A  66
ASP A  86
ASN A 106
PHE A 174
 None
 0.81A 1zq9B-3tqsA:
26.8		 1zq9B-3tqsA:
28.82
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.
3tqs RIBOSOMAL RNA SMALL
SUBUNIT
METHYLTRANSFERASE A

(Coxiella
burnetii) 		PF00398
(RrnaAD) 		9 HIS A  13
GLY A  40
GLY A  42
LEU A  66
ASN A 106
LEU A 107
PRO A 108
ILE A 111
PHE A 174
 None
 0.89A 1zq9B-3tqsA:
26.8		 1zq9B-3tqsA:
28.82
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.
3tzq SHORT-CHAIN TYPE
DEHYDROGENASE/REDUCT
ASE

(Mycobacterium
marinum) 		no annotation 5 GLY B  14
GLY B  17
LEU B  39
ASP B  61
VAL B  60
 None
 0.95A 1zq9B-3tzqB:
6.2		 1zq9B-3tzqB:
20.60
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3uzu RIBOSOMAL RNA SMALL
SUBUNIT
METHYLTRANSFERASE A

(Burkholderia
pseudomallei) 		PF00398
(RrnaAD) 		7 GLY A  46
GLY A  48
ASN A 117
LEU A 118
PRO A 119
ILE A 122
PHE A 185
 None
 1.13A 1zq9B-3uzuA:
25.5		 1zq9B-3uzuA:
30.77
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3uzu RIBOSOMAL RNA SMALL
SUBUNIT
METHYLTRANSFERASE A

(Burkholderia
pseudomallei) 		PF00398
(RrnaAD) 		8 GLY A  46
GLY A  48
LEU A  76
ASP A  94
ASN A 117
PRO A 119
ILE A 122
PHE A 185
 None
 0.73A 1zq9B-3uzuA:
25.5		 1zq9B-3uzuA:
30.77
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3uzu RIBOSOMAL RNA SMALL
SUBUNIT
METHYLTRANSFERASE A

(Burkholderia
pseudomallei) 		PF00398
(RrnaAD) 		6 GLY A 116
ASN A 117
LEU A 118
PRO A 119
ILE A 122
PHE A 185
 None
 1.37A 1zq9B-3uzuA:
25.5		 1zq9B-3uzuA:
30.77
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.
3w08 ALDOXIME DEHYDRATASE

(Pseudomonas
chlororaphis) 		PF13816
(Dehydratase_hem) 		5 HIS A 320
GLY A 154
GLY A 156
VAL A  96
ILE A 280
 None
 0.99A 1zq9B-3w08A:
undetectable		 1zq9B-3w08A:
20.59
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.
3zuy TRANSPORTER

(Neisseria
meningitidis) 		PF01758
(SBF) 		5 VAL A 228
ASN A  93
LEU A  94
PRO A  95
ILE A  98
 None
 0.85A 1zq9B-3zuyA:
undetectable		 1zq9B-3zuyA:
20.42
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.
4cql ESTRADIOL
17-BETA-DEHYDROGENAS
E 8

(Homo sapiens) 		PF13561
(adh_short_C2) 		5 GLY A  18
GLY A  20
LEU A  43
ASP A  75
VAL A  76
 NAD  A 301 (-3.6A)
NAD  A 301 ( 3.9A)
NAD  A 301 (-4.0A)
NAD  A 301 (-3.4A)
NAD  A 301 (-3.6A)
 0.81A 1zq9B-4cqlA:
5.9		 1zq9B-4cqlA:
23.61
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.
4eut SERINE/THREONINE-PRO
TEIN KINASE TBK1

(Homo sapiens) 		PF00069
(Pkinase) 		5 GLY A 217
VAL A 115
LEU A  94
PRO A 138
ILE A 141
 None
 1.01A 1zq9B-4eutA:
undetectable		 1zq9B-4eutA:
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.
4fc7 PEROXISOMAL
2,4-DIENOYL-COA
REDUCTASE

(Homo sapiens) 		PF13561
(adh_short_C2) 		5 GLY A  35
GLY A  37
ASP A  86
VAL A  87
ILE A 136
 NAP  A 401 (-3.5A)
NAP  A 401 ( 4.9A)
NAP  A 401 (-3.2A)
NAP  A 401 (-3.6A)
NAP  A 401 (-3.8A)
 0.87A 1zq9B-4fc7A:
6.1		 1zq9B-4fc7A:
23.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4fn4 SHORT CHAIN
DEHYDROGENASE

(Sulfolobus
acidocaldarius) 		PF13561
(adh_short_C2) 		5 GLY A  15
GLY A  17
LEU A  40
ASP A  65
VAL A  66
 NAD  A 501 (-3.2A)
NAD  A 501 ( 4.0A)
NAD  A 501 (-3.8A)
NAD  A 501 (-3.6A)
NAD  A 501 (-3.6A)
 0.77A 1zq9B-4fn4A:
6.3		 1zq9B-4fn4A:
24.84
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.
4g2r ACCD6,
CARBOXYLTRANSFERASE
BETA-SUBUNIT OF
ACYL-COA CARBOXYLASE

(Mycobacterium
tuberculosis) 		PF01039
(Carboxyl_trans) 		5 GLY A 293
LEU A 289
ASP A 243
VAL A 244
PRO A 267
 None
 0.91A 1zq9B-4g2rA:
undetectable		 1zq9B-4g2rA:
20.26
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4gc5 DIMETHYLADENOSINE
TRANSFERASE 1,
MITOCHONDRIAL

(Mus musculus) 		PF00398
(RrnaAD) 		6 GLY A  63
GLY A  65
ASP A 111
LEU A 142
PRO A 143
PHE A 217
 ACT  A 402 (-3.4A)
None
None
None
ACT  A 402 ( 4.9A)
None
 1.03A 1zq9B-4gc5A:
25.0		 1zq9B-4gc5A:
30.33
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4gc5 DIMETHYLADENOSINE
TRANSFERASE 1,
MITOCHONDRIAL

(Mus musculus) 		PF00398
(RrnaAD) 		7 GLY A  65
ASP A 111
VAL A 112
ASN A 141
LEU A 142
PRO A 143
PHE A 217
 None
None
None
None
None
ACT  A 402 ( 4.9A)
None
 0.94A 1zq9B-4gc5A:
25.0		 1zq9B-4gc5A:
30.33
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.
4gys ALLOPHANATE
HYDROLASE

(Granulibacter
bethesdensis) 		PF01425
(Amidase) 		5 GLY A 446
GLY A 448
LEU A 182
ASP A 437
PRO A 455
 None
 0.87A 1zq9B-4gysA:
undetectable		 1zq9B-4gysA:
19.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4hkt INOSITOL
2-DEHYDROGENASE

(Sinorhizobium
meliloti) 		PF01408
(GFO_IDH_MocA)
PF02894
(GFO_IDH_MocA_C) 		5 GLY A 307
GLY A 304
LEU A 106
PRO A  94
PHE A  90
 None
GOL  A 413 (-3.6A)
None
None
None
 0.94A 1zq9B-4hktA:
5.8		 1zq9B-4hktA:
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.
4ine PROTEIN PMT-2

(Caenorhabditis
elegans) 		PF08241
(Methyltransf_11) 		5 GLY A 232
GLY A 234
LEU A 255
ASP A 281
ILE A 304
 SAH  A 501 (-3.6A)
SAH  A 501 (-3.6A)
SAH  A 501 (-4.3A)
SAH  A 501 (-3.5A)
SAH  A 501 ( 4.5A)
 0.92A 1zq9B-4ineA:
8.1		 1zq9B-4ineA:
19.28
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.
4itu SHORT-CHAIN
DEHYDROGENASE/REDUCT
ASE SDR

(Xanthobacter
autotrophicus) 		PF13561
(adh_short_C2) 		6 GLY A  14
GLY A  16
LEU A  39
LEU A  43
ASP A  64
VAL A  65
 NAI  A 301 (-3.3A)
NAI  A 301 ( 4.6A)
NAI  A 301 (-3.9A)
None
NAI  A 301 (-3.6A)
NAI  A 301 (-3.5A)
 0.84A 1zq9B-4ituA:
6.0		 1zq9B-4ituA:
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.
4itu SHORT-CHAIN
DEHYDROGENASE/REDUCT
ASE SDR

(Xanthobacter
autotrophicus) 		PF13561
(adh_short_C2) 		5 GLY A  16
LEU A  39
LEU A  43
ASP A  64
ASN A  91
 NAI  A 301 ( 4.6A)
NAI  A 301 (-3.9A)
None
NAI  A 301 (-3.6A)
NAI  A 301 (-3.4A)
 0.84A 1zq9B-4ituA:
6.0		 1zq9B-4ituA:
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.
4jxj RIBOSOMAL RNA SMALL
SUBUNIT
METHYLTRANSFERASE A

(Rickettsia
bellii) 		PF00398
(RrnaAD) 		5 GLY A  50
GLY A  52
ASN A 116
ILE A 121
PHE A 184
 None
 0.54A 1zq9B-4jxjA:
25.7		 1zq9B-4jxjA:
29.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4lds BICYCLOMYCIN
RESISTANCE PROTEIN
TCAB

(Staphylococcus
epidermidis) 		PF00083
(Sugar_tr) 		5 GLY A  20
GLY A 143
LEU A  17
VAL A 109
ILE A 105
 None
 0.91A 1zq9B-4ldsA:
undetectable		 1zq9B-4ldsA:
19.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4lk3 UDP-GLUCURONIC ACID
DECARBOXYLASE 1

(Homo sapiens) 		PF16363
(GDP_Man_Dehyd) 		5 GLY A  95
GLY A  98
ASP A 144
VAL A 145
PRO A 162
 NAD  A 501 (-3.3A)
NAD  A 501 (-3.1A)
NAD  A 501 (-3.1A)
NAD  A 501 (-3.6A)
NAD  A 501 ( 4.0A)
 0.92A 1zq9B-4lk3A:
5.5		 1zq9B-4lk3A:
20.44
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4lnv THIOESTER-CONTAINING
PROTEIN I

(Anopheles
gambiae) 		PF00207
(A2M)
PF01835
(A2M_N)
PF07677
(A2M_recep)
PF07678
(A2M_comp)
PF07703
(A2M_N_2)
PF10569
(Thiol-ester_cl) 		5 VAL A 770
ASN A 692
LEU A 693
PRO A 694
ILE A 789
 None
 1.02A 1zq9B-4lnvA:
undetectable		 1zq9B-4lnvA:
12.69
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4mhb PUTATIVE ALDO/KETO
REDUCTASE

(Yersinia pestis) 		PF00248
(Aldo_ket_red) 		5 GLY A 206
VAL A 212
LEU A 271
PRO A 176
ILE A 268
 None
 0.90A 1zq9B-4mhbA:
undetectable		 1zq9B-4mhbA:
23.27
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.
4nec PUTATIVE
SAM-DEPENDENT
METHYLTRANSFERASE

(Streptomyces
lasaliensis) 		PF13649
(Methyltransf_25) 		5 GLY A  47
GLY A  49
LEU A  69
ASP A  94
LEU A 113
 SAH  A 401 (-3.9A)
SAH  A 401 (-3.6A)
SAH  A 401 (-3.7A)
SAH  A 401 ( 3.6A)
SAH  A 401 (-4.1A)
 0.88A 1zq9B-4necA:
10.9		 1zq9B-4necA:
20.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ovr TRAP DICARBOXYLATE
TRANSPORTER, DCTP
SUBUNIT

(Xanthobacter
autotrophicus) 		PF03480
(DctP) 		5 HIS A 230
GLY A  92
VAL A 308
LEU A 106
PRO A 107
 None
 1.00A 1zq9B-4ovrA:
undetectable		 1zq9B-4ovrA:
20.80
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.
4pn3 3-HYDROXYACYL-COA
DEHYDROGENASE

(Brucella
melitensis) 		PF00106
(adh_short) 		5 GLY A  12
GLY A  14
ASP A  59
VAL A  60
ILE A 113
 None
 0.67A 1zq9B-4pn3A:
6.0		 1zq9B-4pn3A:
22.70
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.
4trr PUTATIVE
D-BETA-HYDROXYBUTYRA
TE DEHYDROGENASE

(Burkholderia
cenocepacia) 		PF00106
(adh_short) 		5 GLY A  13
LEU A  38
ASP A  63
VAL A  64
ILE A 113
 None
 0.90A 1zq9B-4trrA:
5.8		 1zq9B-4trrA:
23.42
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.
4txw HYALURONOGLUCOSAMINI
DASE

(Clostridium
perfringens) 		PF00754
(F5_F8_type_C) 		5 GLY A 154
VAL A 131
ASN A  49
LEU A  50
ILE A  67
 None
 1.01A 1zq9B-4txwA:
undetectable		 1zq9B-4txwA:
19.93
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.
4yio SUPEROXIDE DISMUTASE

(Streptococcus
thermophilus) 		PF00081
(Sod_Fe_N)
PF02777
(Sod_Fe_C) 		5 GLY A  74
GLY A  76
ASN A  73
LEU A  70
ILE A  62
 None
 1.01A 1zq9B-4yioA:
undetectable		 1zq9B-4yioA:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ccx TRNA
(ADENINE(58)-N(1))-M
ETHYLTRANSFERASE
CATALYTIC SUBUNIT
TRMT61A

(Homo sapiens) 		PF08704
(GCD14) 		5 GLY A 111
GLY A 113
ASP A 163
VAL A 164
PRO A 183
 SAH  A 301 (-3.2A)
SAH  A 301 (-2.9A)
SAH  A 301 (-2.7A)
SAH  A 301 (-4.0A)
SAH  A 301 (-4.0A)
 0.58A 1zq9B-5ccxA:
15.2		 1zq9B-5ccxA:
20.58
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.
5erg TRNA
(ADENINE(58)-N(1))-M
ETHYLTRANSFERASE
CATALYTIC SUBUNIT
TRM61

(Saccharomyces
cerevisiae) 		PF08704
(GCD14) 		6 GLY B 118
GLY B 120
ASP B 168
VAL B 169
LEU B 204
PRO B 205
 SAM  B 401 (-3.4A)
SAM  B 401 (-3.3A)
SAM  B 401 (-3.5A)
SAM  B 401 (-3.7A)
SAM  B 401 (-4.5A)
SAM  B 401 ( 4.9A)
 0.64A 1zq9B-5ergB:
13.6		 1zq9B-5ergB:
22.65
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.
5fl3 PILI RETRACTION
PROTEIN PILT

(Thermus
thermophilus) 		PF00437
(T2SSE) 		5 GLY A 272
LEU A 135
VAL A 300
LEU A 294
ILE A 313
 None
 0.95A 1zq9B-5fl3A:
undetectable		 1zq9B-5fl3A:
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.
5hcc COMPLEMENT C5

(Homo sapiens) 		PF00207
(A2M)
PF01759
(NTR)
PF01821
(ANATO)
PF07677
(A2M_recep)
PF07678
(A2M_comp) 		5 HIS A1030
GLY A 981
GLY A 985
LEU A1356
LEU A1309
 None
 0.95A 1zq9B-5hccA:
undetectable		 1zq9B-5hccA:
13.93
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.
5hnz PROTEIN CLARET
SEGREGATIONAL,PROTEI
N CLARET
SEGREGATIONAL,PLUS-E
ND DIRECTED
KINESIN-1/KINESIN-14
,PROTEIN CLARET
SEGREGATIONAL,PROTEI
N CLARET
SEGREGATIONAL

(Drosophila
melanogaster;
Rattus
norvegicus) 		PF00225
(Kinesin) 		5 HIS K 216
GLY K 122
GLY K 113
LEU K 115
ILE K  97
 None
 1.01A 1zq9B-5hnzK:
undetectable		 1zq9B-5hnzK:
23.16
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.
5ilg PHOTORECEPTOR
DEHYDROGENASE,
ISOFORM C

(Drosophila
melanogaster) 		PF00106
(adh_short) 		5 GLY A  12
GLY A  15
LEU A  38
ASP A  63
VAL A  64
 NAD  A 302 (-3.2A)
NAD  A 302 (-3.6A)
NAD  A 302 (-4.2A)
NAD  A 302 (-3.6A)
NAD  A 302 (-3.6A)
 0.84A 1zq9B-5ilgA:
4.3		 1zq9B-5ilgA:
22.96
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.
5kr6 4-AMINOBUTYRATE
TRANSAMINASE

(Pseudomonas) 		PF00202
(Aminotran_3) 		5 GLY A 380
GLY A 378
LEU A 381
PRO A 431
ILE A 435
 None
 0.97A 1zq9B-5kr6A:
undetectable		 1zq9B-5kr6A:
19.63
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.
5lh9 OMEGA TRANSAMINASE

(Pseudomonas sp.) 		PF00202
(Aminotran_3) 		6 GLY A 376
GLY A 374
LEU A 355
VAL A 351
LEU A 377
PRO A 425
 None
 1.38A 1zq9B-5lh9A:
2.0		 1zq9B-5lh9A:
19.73
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.
5n4w CULLIN-2

(Homo sapiens) 		PF00888
(Cullin)
PF10557
(Cullin_Nedd8) 		5 LEU A  77
VAL A  83
LEU A 155
PRO A 154
ILE A 158
 None
 1.00A 1zq9B-5n4wA:
undetectable		 1zq9B-5n4wA:
18.14
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.
5nsq AMINOPEPTIDASE,
PUTATIVE

(Trypanosoma
brucei) 		PF00883
(Peptidase_M17) 		5 GLY A 315
GLY A 288
LEU A 339
VAL A 213
PRO A 511
 None
 1.01A 1zq9B-5nsqA:
undetectable		 1zq9B-5nsqA:
21.06
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.
5ntf AMINOPEPTIDASE

(Trypanosoma
cruzi) 		PF00883
(Peptidase_M17) 		5 GLY A 314
GLY A 287
LEU A 338
VAL A 212
PRO A 510
 None
 0.99A 1zq9B-5ntfA:
undetectable		 1zq9B-5ntfA:
20.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5o1p ALPHA-AMINOADIPIC
SEMIALDEHYDE
SYNTHASE,
MITOCHONDRIAL

(Homo sapiens) 		PF03435
(Sacchrp_dh_NADP)
PF16653
(Sacchrp_dh_C) 		5 GLY A 487
GLY A 489
ASP A 532
LEU A 554
PRO A 555
 None
 0.84A 1zq9B-5o1pA:
5.9		 1zq9B-5o1pA:
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.
5uow N-METHYL-D-ASPARTATE
RECEPTOR SUBUNIT
NR1-8A

(Xenopus laevis) 		PF00060
(Lig_chan)
PF01094
(ANF_receptor)
PF10613
(Lig_chan-Glu_bd) 		6 GLY A 250
LEU A 248
LEU A 221
VAL A 150
LEU A 269
ILE A 353
 None
 1.14A 1zq9B-5uowA:
undetectable		 1zq9B-5uowA:
17.31
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5upr TRIOSEPHOSPHATE
ISOMERASE

(Toxoplasma
gondii) 		PF00121
(TIM) 		5 GLY A 249
LEU A 264
VAL A 271
LEU A 246
ILE A 284
 None
 0.95A 1zq9B-5uprA:
2.5		 1zq9B-5uprA:
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.
5wp4 PHOSPHOETHANOLAMINE
N-METHYLTRANSFERASE
1

(Arabidopsis
thaliana) 		no annotation 5 GLY A  61
GLY A  63
ASP A 107
VAL A 108
LEU A 128
 SAH  A 701 (-3.4A)
SAH  A 701 (-3.5A)
SAH  A 701 (-3.2A)
SAH  A 701 (-3.6A)
None
 0.93A 1zq9B-5wp4A:
12.8		 1zq9B-5wp4A:
19.32
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.
5wp4 PHOSPHOETHANOLAMINE
N-METHYLTRANSFERASE
1

(Arabidopsis
thaliana) 		no annotation 5 GLY A 290
GLY A 292
LEU A 313
ASP A 338
ILE A 361
 SAH  A 703 (-4.0A)
SAH  A 703 ( 3.7A)
SAH  A 703 (-4.1A)
SAH  A 703 (-3.3A)
None
 0.83A 1zq9B-5wp4A:
12.8		 1zq9B-5wp4A:
19.32
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.
5wp5 PHOSPHOMETHYLETHANOL
AMINE
N-METHYLTRANSFERASE
2

(Arabidopsis
thaliana) 		no annotation 5 GLY A  61
GLY A  63
ASP A 107
VAL A 108
LEU A 128
 SAH  A 502 (-3.4A)
SAH  A 502 (-3.5A)
SAH  A 502 (-3.2A)
SAH  A 502 (-3.6A)
None
 0.98A 1zq9B-5wp5A:
12.6		 1zq9B-5wp5A:
19.47
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.
5wp5 PHOSPHOMETHYLETHANOL
AMINE
N-METHYLTRANSFERASE
2

(Arabidopsis
thaliana) 		no annotation 5 GLY A 290
GLY A 292
LEU A 313
ASP A 338
ILE A 361
 SAH  A 501 (-3.8A)
SAH  A 501 (-3.6A)
SAH  A 501 (-3.9A)
SAH  A 501 (-3.4A)
None
 0.79A 1zq9B-5wp5A:
12.6		 1zq9B-5wp5A:
19.47
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.
5xtg 2,3-DIHYDROXY-2,3-DI
HYDROPHENYLPROPIONAT
E DEHYDROGENASE

(Pseudomonas sp.
MC1) 		PF13561
(adh_short_C2) 		5 GLY B  11
GLY B  13
ASP B  58
VAL B  59
ILE B 112
 NAD  B 301 (-3.4A)
NAD  B 301 ( 3.9A)
NAD  B 301 (-2.3A)
NAD  B 301 (-3.9A)
NAD  B 301 ( 4.0A)
 0.89A 1zq9B-5xtgB:
5.7		 1zq9B-5xtgB:
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.
5yeq KETOL-ACID
REDUCTOISOMERASE
(NADP(+))

(Sulfolobus
acidocaldarius) 		no annotation 5 GLY A  24
GLY A  29
LEU A  81
PRO A  82
ILE A  85
 None
 0.98A 1zq9B-5yeqA:
2.7		 1zq9B-5yeqA:
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.
6gct NEUTRAL AMINO ACID
TRANSPORTER B(0)

(Homo sapiens) 		no annotation 5 GLY A 480
LEU A 337
LEU A 321
PRO A 322
PHE A 328
 None
 0.92A 1zq9B-6gctA:
undetectable		 1zq9B-6gctA:
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.
6gdr -

(-) 		no annotation 5 GLY A 187
GLY A 189
LEU A 184
LEU A 179
PHE A 283
 None
 1.01A 1zq9B-6gdrA:
undetectable		 1zq9B-6gdrA:
undetectable