SIMILAR PATTERN OF AMINO ACIDS MAPPED TO 'PCA'


List of Similar Pattern of Amino Acids

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 on the DrReposER ID to view details on interfaces and similar patterns of amino acids)
(Click on the view link on the last column to view superposed patterns of amino acids)
Filter list by:
DrReposER ID / Desc. Hit
PDBID		 Hit
Macromolecule		 Res.
Matches		 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.
1FKP_A_NVPA999_1
(HIV-1 RT, A-CHAIN)		 3juc AIG2-LIKE
DOMAIN-CONTAINING
PROTEIN 1
(Homo
sapiens) 		5 / 11 PRO A  51
VAL A  63
TYR A 137
GLY A  65
LEU A  10
 PCA  A1001 (-4.1A)
None
NO3  A 154 (-4.8A)
None
PCA  A1001 (-3.7A)
 1.26A 1fkpA-3jucA:
undetectable		 1fkpA-3jucA:
14.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1GTI_D_CCSD47_0
(GLUTATHIONE
S-TRANSFERASE)		 1q2e EXOCELLOBIOHYDROLASE
I
(Trichoderma
reesei) 		5 / 7 THR A   5
LEU A  73
GLY A  75
LYS A 166
TYR A 167
 None
PCA  A   1 ( 4.9A)
None
None
None
 1.39A 1gtiD-1q2eA:
0.0		 1gtiD-1q2eA:
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.
1GTI_D_CCSD47_0
(GLUTATHIONE
S-TRANSFERASE)		 2yok EXOGLUCANASE 1
(Trichoderma
harzianum) 		5 / 7 THR A  22
LEU A  89
GLY A  91
LYS A 179
TYR A 180
 None
PCA  A  18 ( 4.5A)
None
None
None
 1.44A 1gtiD-2yokA:
undetectable		 1gtiD-2yokA:
18.33
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.
1GTI_F_CCSF47_0
(GLUTATHIONE
S-TRANSFERASE)		 1q2e EXOCELLOBIOHYDROLASE
I
(Trichoderma
reesei) 		5 / 5 THR A   5
LEU A  73
GLY A  75
LYS A 166
TYR A 167
 None
PCA  A   1 ( 4.9A)
None
None
None
 1.42A 1gtiF-1q2eA:
0.0		 1gtiF-1q2eA:
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.
1GTI_F_CCSF47_0
(GLUTATHIONE
S-TRANSFERASE)		 1q9h CELLOBIOHYDROLASE I
CATALYTIC DOMAIN
(Rasamsonia
emersonii) 		4 / 5 THR A   5
LEU A  73
GLY A  75
TYR A 164
 None
PCA  A   1 ( 4.5A)
None
None
 1.29A 1gtiF-1q9hA:
undetectable		 1gtiF-1q9hA:
18.35
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.
1GTI_F_CCSF47_0
(GLUTATHIONE
S-TRANSFERASE)		 1z3v CELLULASE
(Phanerochaete
chrysosporium) 		5 / 5 THR A   5
LEU A  73
GLY A  75
LYS A 163
TYR A 164
 None
PCA  A   1 ( 4.4A)
None
None
None
 1.49A 1gtiF-1z3vA:
undetectable		 1gtiF-1z3vA:
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.
1GTI_F_CCSF47_0
(GLUTATHIONE
S-TRANSFERASE)		 2yg1 CELLULOSE
1,4-BETA-CELLOBIOSID
ASE
(Heterobasidion
annosum) 		4 / 5 THR A   5
LEU A  73
GLY A  75
TYR A 169
 None
PCA  A   1 ( 4.3A)
None
None
 1.25A 1gtiF-2yg1A:
undetectable		 1gtiF-2yg1A:
19.30
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.
1GTI_F_CCSF47_0
(GLUTATHIONE
S-TRANSFERASE)		 2yok EXOGLUCANASE 1
(Trichoderma
harzianum) 		5 / 5 THR A  22
LEU A  89
GLY A  91
LYS A 179
TYR A 180
 None
PCA  A  18 ( 4.5A)
None
None
None
 1.46A 1gtiF-2yokA:
undetectable		 1gtiF-2yokA:
18.33
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.
1GTI_F_CCSF47_0
(GLUTATHIONE
S-TRANSFERASE)		 4v20 CELLOBIOHYDROLASE
(Aspergillus
fumigatus) 		4 / 5 THR A   5
LEU A  73
GLY A  75
TYR A 167
 ACT  A1444 (-3.9A)
PCA  A   1 ( 4.5A)
None
None
 1.26A 1gtiF-4v20A:
undetectable		 1gtiF-4v20A:
17.67
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.
1GTI_F_CCSF47_0
(GLUTATHIONE
S-TRANSFERASE)		 5o5d GLUCANASE
(Trichoderma
atroviride) 		4 / 5 THR A   5
LEU A  73
GLY A  75
TYR A 167
 None
PCA  A   1 ( 4.6A)
None
None
 1.30A 1gtiF-5o5dA:
undetectable		 1gtiF-5o5dA:
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.
1HTT_D_HISD450_0
(HISTIDYL-TRNA
SYNTHETASE)		 1ovw ENDOGLUCANASE I
(Fusarium
oxysporum) 		5 / 12 LEU A 110
TYR A 117
GLY A 153
GLY A 170
ALA A 163
 None
None
None
None
PCA  A   1 ( 4.3A)
 1.18A 1httD-1ovwA:
undetectable		 1httD-1ovwA:
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.
1HZE_A_RBFA98_1
(RIBOFLAVIN SYNTHASE
ALPHA CHAIN)		 5w11 GLUCANASE
(Thermothelomyces
thermophila) 		5 / 9 ASP A 180
LEU A 181
ILE A  73
THR A 109
ILE A  34
 CTR  A 505 (-3.8A)
None
PCA  A   1 ( 4.8A)
None
None
 1.46A 1hzeA-5w11A:
undetectable
1hzeB-5w11A:
undetectable		 1hzeA-5w11A:
21.18
1hzeB-5w11A:
21.18
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.
1HZE_B_RBFB99_1
(RIBOFLAVIN SYNTHASE
ALPHA CHAIN)		 5w11 GLUCANASE
(Thermothelomyces
thermophila) 		5 / 9 THR A 109
ILE A  34
ASP A 180
LEU A 181
ILE A  73
 None
None
CTR  A 505 (-3.8A)
None
PCA  A   1 ( 4.8A)
 1.46A 1hzeA-5w11A:
undetectable
1hzeB-5w11A:
undetectable		 1hzeA-5w11A:
21.18
1hzeB-5w11A:
21.18
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.
1LWC_A_NVPA999_1
(HIV-1 REVERSE
TRANSCRIPTASE)		 3juc AIG2-LIKE
DOMAIN-CONTAINING
PROTEIN 1
(Homo
sapiens) 		5 / 11 PRO A  51
VAL A  63
TYR A 137
GLY A  65
LEU A  10
 PCA  A1001 (-4.1A)
None
NO3  A 154 (-4.8A)
None
PCA  A1001 (-3.7A)
 1.20A 1lwcA-3jucA:
undetectable		 1lwcA-3jucA:
13.76
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.
1MCN_P_DHIP1_0
(IMMUNOGLOBULIN
LAMBDA DIMER MCG
(LIGHT CHAIN)
PEPTIDE
N-ACETYL-D-HIS-L-PRO
-NH2)		 5lcs GALLINACIN-7
(Gallus
gallus) 		3 / 3 PHE A   3
TYR A  28
PRO A   5
 PCA  A   1 ( 4.8A)
None
PCA  A   1 ( 3.5A)
 1.01A 1mcnA-5lcsA:
undetectable
1mcnB-5lcsA:
undetectable
1mcnP-5lcsA:
undetectable		 1mcnA-5lcsA:
8.80
1mcnB-5lcsA:
8.80
1mcnP-5lcsA:
16.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1MXD_A_ACRA733_1
(ALPHA AMYLASE)		 2yg1 CELLULOSE
1,4-BETA-CELLOBIOSID
ASE
(Heterobasidion
annosum) 		4 / 6 SER A 167
THR A 171
LEU A  34
ASP A  35
 None
PCA  A   1 ( 4.9A)
None
None
 1.28A 1mxdA-2yg1A:
undetectable		 1mxdA-2yg1A:
19.75
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.
1P6K_B_ACTB861_0
(NITRIC-OXIDE
SYNTHASE, BRAIN)		 4xmp HEAVY CHAIN OF
ANTIBODY VRC08
(Homo
sapiens) 		4 / 5 GLY H  95
GLN H 101
VAL H   2
SER H  97
 None
None
PCA  H   1 ( 3.3A)
None
 1.27A 1p6kB-4xmpH:
undetectable		 1p6kB-4xmpH:
22.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1RG1_A_SPMA999_1
(TYROSYL-DNA
PHOSPHODIESTERASE 1)		 1ym0 FIBRINOTIC ENZYME
COMPONENT B
(Eisenia
fetida) 		3 / 3 TRP B   1
VAL B   1
PRO B   1
 None
None
PCA  B   1 ( 4.5A)
 0.88A 1rg1A-1ym0B:
undetectable		 1rg1A-1ym0B:
5.26
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.
1RH0_A_SPMA999_1
(TYROSYL-DNA
PHOSPHODIESTERASE 1)		 1ym0 FIBRINOTIC ENZYME
COMPONENT B
(Eisenia
fetida) 		3 / 3 TRP B   1
VAL B   1
PRO B   1
 None
None
PCA  B   1 ( 4.5A)
 0.88A 1rh0A-1ym0B:
undetectable		 1rh0A-1ym0B:
5.26
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.
1RS6_B_ACTB861_0
(NITRIC-OXIDE
SYNTHASE, BRAIN)		 4xmp HEAVY CHAIN OF
ANTIBODY VRC08
(Homo
sapiens) 		4 / 5 GLY H  95
GLN H 101
VAL H   2
SER H  97
 None
None
PCA  H   1 ( 3.3A)
None
 1.26A 1rs6B-4xmpH:
undetectable		 1rs6B-4xmpH:
21.77
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.
1YKI_A_NFZA1219_1
(OXYGEN-INSENSITIVE
NAD(P)H
NITROREDUCTASE)		 1z3v CELLULASE
(Phanerochaete
chrysosporium) 		4 / 8 TYR A 155
PHE A 179
ASN A 158
GLY A 151
 None
PCA  A   1 ( 3.6A)
PCA  A   1 ( 3.6A)
None
 1.07A 1ykiA-1z3vA:
undetectable
1ykiB-1z3vA:
undetectable		 1ykiA-1z3vA:
17.91
1ykiB-1z3vA:
17.91
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.
1YKI_A_NFZA1219_1
(OXYGEN-INSENSITIVE
NAD(P)H
NITROREDUCTASE)		 5w11 GLUCANASE
(Thermothelomyces
thermophila) 		4 / 8 TYR A 159
PHE A 183
ASN A 162
GLY A 155
 None
PCA  A   1 ( 3.3A)
PCA  A   1 ( 3.7A)
None
 1.08A 1ykiA-5w11A:
undetectable
1ykiB-5w11A:
undetectable		 1ykiA-5w11A:
14.75
1ykiB-5w11A:
14.75
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.
1YKI_B_NFZB2219_1
(OXYGEN-INSENSITIVE
NAD(P)H
NITROREDUCTASE)		 1z3v CELLULASE
(Phanerochaete
chrysosporium) 		4 / 8 TYR A 155
PHE A 179
ASN A 158
GLY A 151
 None
PCA  A   1 ( 3.6A)
PCA  A   1 ( 3.6A)
None
 1.08A 1ykiA-1z3vA:
undetectable
1ykiB-1z3vA:
undetectable		 1ykiA-1z3vA:
17.91
1ykiB-1z3vA:
17.91
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.
1YKI_B_NFZB2219_1
(OXYGEN-INSENSITIVE
NAD(P)H
NITROREDUCTASE)		 5w11 GLUCANASE
(Thermothelomyces
thermophila) 		4 / 8 TYR A 159
PHE A 183
ASN A 162
GLY A 155
 None
PCA  A   1 ( 3.3A)
PCA  A   1 ( 3.7A)
None
 1.09A 1ykiA-5w11A:
undetectable
1ykiB-5w11A:
undetectable		 1ykiA-5w11A:
14.75
1ykiB-5w11A:
14.75
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.
1YKI_D_NFZD4219_1
(OXYGEN-INSENSITIVE
NAD(P)H
NITROREDUCTASE)		 1rcl RIBONUCLEASE F1
(Fusarium
fujikuroi) 		4 / 8 THR A  90
TYR A  85
PHE A  59
GLY A  87
 None
PCA  A   1 ( 3.5A)
None
None
 1.08A 1ykiC-1rclA:
0.0
1ykiD-1rclA:
0.0		 1ykiC-1rclA:
17.54
1ykiD-1rclA:
17.54
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.
1YKI_D_NFZD4219_1
(OXYGEN-INSENSITIVE
NAD(P)H
NITROREDUCTASE)		 1z3v CELLULASE
(Phanerochaete
chrysosporium) 		4 / 8 TYR A 155
PHE A 179
ASN A 158
GLY A 151
 None
PCA  A   1 ( 3.6A)
PCA  A   1 ( 3.6A)
None
 1.02A 1ykiC-1z3vA:
undetectable
1ykiD-1z3vA:
undetectable		 1ykiC-1z3vA:
17.91
1ykiD-1z3vA:
17.91
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.
1YKI_D_NFZD4219_1
(OXYGEN-INSENSITIVE
NAD(P)H
NITROREDUCTASE)		 2yok EXOGLUCANASE 1
(Trichoderma
harzianum) 		4 / 8 TYR A 171
PHE A 195
ASN A 174
GLY A 167
 None
PCA  A  18 ( 3.7A)
PCA  A  18 ( 3.6A)
None
 1.09A 1ykiC-2yokA:
undetectable
1ykiD-2yokA:
undetectable		 1ykiC-2yokA:
18.25
1ykiD-2yokA:
18.25
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.
1YKI_D_NFZD4219_1
(OXYGEN-INSENSITIVE
NAD(P)H
NITROREDUCTASE)		 4csi CELLULASE
(Humicola
grisea) 		4 / 8 TYR A 159
PHE A 183
ASN A 162
GLY A 155
 None
PCA  A   1 ( 3.6A)
PCA  A   1 ( 3.7A)
None
 1.05A 1ykiC-4csiA:
undetectable
1ykiD-4csiA:
undetectable		 1ykiC-4csiA:
18.14
1ykiD-4csiA:
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.
1YKI_D_NFZD4219_1
(OXYGEN-INSENSITIVE
NAD(P)H
NITROREDUCTASE)		 4haq GH7 FAMILY PROTEIN
(Limnoria
quadripunctata) 		4 / 8 TYR A 179
PHE A 203
ASN A 182
GLY A 175
 None
PCA  A  23 ( 3.7A)
PCA  A  23 ( 3.3A)
None
 1.05A 1ykiC-4haqA:
undetectable
1ykiD-4haqA:
undetectable		 1ykiC-4haqA:
19.54
1ykiD-4haqA:
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.
1YKI_D_NFZD4219_1
(OXYGEN-INSENSITIVE
NAD(P)H
NITROREDUCTASE)		 4xeb GLUCANASE
(Talaromyces
funiculosus) 		4 / 8 TYR A 155
PHE A 179
ASN A 158
GLY A 151
 None
PCA  A   1 ( 3.7A)
PCA  A   1 ( 3.7A)
None
 1.06A 1ykiC-4xebA:
undetectable
1ykiD-4xebA:
undetectable		 1ykiC-4xebA:
18.18
1ykiD-4xebA:
18.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1YKI_D_NFZD4219_1
(OXYGEN-INSENSITIVE
NAD(P)H
NITROREDUCTASE)		 5w11 GLUCANASE
(Thermothelomyces
thermophila) 		4 / 8 TYR A 159
PHE A 183
ASN A 162
GLY A 155
 None
PCA  A   1 ( 3.3A)
PCA  A   1 ( 3.7A)
None
 1.03A 1ykiC-5w11A:
undetectable
1ykiD-5w11A:
undetectable		 1ykiC-5w11A:
14.75
1ykiD-5w11A:
14.75
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.
1ZZ1_B_SHHB2552_1
(HISTONE
DEACETYLASE-LIKE
AMIDOHYDROLASE)		 4jp6 PAPAYA BARWIN-LIKE
PROTEIN
(Carica
papaya) 		5 / 12 LEU A  65
ILE A  80
HIS A  56
GLY A  87
PHE A 117
 None
None
None
None
PCA  A   1 ( 4.2A)
 1.14A 1zz1B-4jp6A:
undetectable
1zz1C-4jp6A:
undetectable		 1zz1B-4jp6A:
15.80
1zz1C-4jp6A:
15.80
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.
1ZZQ_B_ACTB861_0
(NITRIC-OXIDE
SYNTHASE, BRAIN)		 4xmp HEAVY CHAIN OF
ANTIBODY VRC08
(Homo
sapiens) 		4 / 5 GLY H  95
GLN H 101
VAL H   2
SER H  97
 None
None
PCA  H   1 ( 3.3A)
None
 1.49A 1zzqB-4xmpH:
undetectable		 1zzqB-4xmpH:
21.96
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.
1ZZU_B_ACTB861_0
(NITRIC-OXIDE
SYNTHASE, BRAIN)		 4xmp HEAVY CHAIN OF
ANTIBODY VRC08
(Homo
sapiens) 		4 / 5 GLY H  95
GLN H 101
VAL H   2
SER H  97
 None
None
PCA  H   1 ( 3.3A)
None
 1.27A 1zzuB-4xmpH:
undetectable		 1zzuB-4xmpH:
22.20
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.
2CBR_A_A80A201_1
(PROTEIN (CRABP-I))		 4csi CELLULASE
(Humicola
grisea) 		5 / 12 VAL A  73
THR A 209
GLY A 165
ARG A 108
TYR A 146
 PCA  A   1 ( 4.9A)
None
None
None
PEG  A1439 (-3.9A)
 1.02A 2cbrA-4csiA:
undetectable		 2cbrA-4csiA:
14.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2F80_B_017B301_2
(POL POLYPROTEIN)		 5w11 GLUCANASE
(Thermothelomyces
thermophila) 		5 / 12 GLY A 165
ALA A 164
ASN A   2
GLY A 186
ILE A  73
 None
PCA  A   1 ( 3.7A)
PCA  A   1 ( 4.5A)
PCA  A   1 ( 3.3A)
PCA  A   1 ( 4.8A)
 0.68A 2f80B-5w11A:
undetectable		 2f80B-5w11A:
16.00
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.
2J9C_C_ACTC1120_0
(HYPOTHETICAL
NITROGEN REGULATORY
PII-LIKE PROTEIN
MJ0059)		 4gft NANOBODY
(Lama
glama) 		3 / 3 LYS B   3
TYR B  34
PRO B  27
 PCA  B   2 ( 3.5A)
None
PCA  B   2 ( 4.5A)
 1.44A 2j9cC-4gftB:
undetectable		 2j9cC-4gftB:
22.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2NYR_B_SVRB401_2
(NAD-DEPENDENT
DEACETYLASE
SIRTUIN-5)		 4zzq CELLULOSE
1,4-BETA-CELLOBIOSID
ASE
(Dictyostelium
discoideum) 		4 / 6 PHE A 181
GLN A 234
ASN A 115
LEU A 118
 PCA  A   1 ( 3.5A)
None
None
None
 1.06A 2nyrA-4zzqA:
undetectable		 2nyrA-4zzqA:
18.45
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.
2PKM_A_ADNA501_1
(ADENOSINE KINASE)		 4haq GH7 FAMILY PROTEIN
(Limnoria
quadripunctata) 		6 / 12 ALA A 186
GLY A 174
GLY A 185
ASN A 182
ALA A  25
GLY A 206
 None
None
None
PCA  A  23 ( 3.3A)
None
PCA  A  23 ( 3.1A)
 1.40A 2pkmA-4haqA:
undetectable		 2pkmA-4haqA:
22.00
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.
2PYM_A_1UNA1001_1
(PROTEASE RETROPEPSIN)		 5w11 GLUCANASE
(Thermothelomyces
thermophila) 		5 / 12 GLY A 165
ALA A 164
ASN A   2
GLY A 186
ILE A  73
 None
PCA  A   1 ( 3.7A)
PCA  A   1 ( 4.5A)
PCA  A   1 ( 3.3A)
PCA  A   1 ( 4.8A)
 0.68A 2pymA-5w11A:
undetectable		 2pymA-5w11A:
15.84
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.
2PYN_A_1UNA1001_1
(PROTEASE RETROPEPSIN)		 5w11 GLUCANASE
(Thermothelomyces
thermophila) 		5 / 12 GLY A 165
ALA A 164
ASN A   2
GLY A 186
ILE A  73
 None
PCA  A   1 ( 3.7A)
PCA  A   1 ( 4.5A)
PCA  A   1 ( 3.3A)
PCA  A   1 ( 4.8A)
 0.74A 2pynA-5w11A:
undetectable		 2pynA-5w11A:
15.00
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.
2PYN_A_1UNA1001_2
(PROTEASE RETROPEPSIN)		 5w11 GLUCANASE
(Thermothelomyces
thermophila) 		5 / 12 GLY A 165
ALA A 164
ASN A   2
GLY A 186
ILE A  73
 None
PCA  A   1 ( 3.7A)
PCA  A   1 ( 4.5A)
PCA  A   1 ( 3.3A)
PCA  A   1 ( 4.8A)
 0.75A 2pynB-5w11A:
undetectable		 2pynB-5w11A:
15.00
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.
2Q64_B_1UNB1001_1
(PROTEASE RETROPEPSIN)		 5w11 GLUCANASE
(Thermothelomyces
thermophila) 		5 / 12 GLY A 165
ALA A 164
ASN A   2
GLY A 186
ILE A  73
 None
PCA  A   1 ( 3.7A)
PCA  A   1 ( 4.5A)
PCA  A   1 ( 3.3A)
PCA  A   1 ( 4.8A)
 0.70A 2q64A-5w11A:
undetectable		 2q64A-5w11A:
15.00
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.
2QAK_A_1UNA1001_3
(PROTEASE RETROPEPSIN)		 5w11 GLUCANASE
(Thermothelomyces
thermophila) 		5 / 12 GLY A 165
ALA A 164
ASN A   2
GLY A 186
ILE A  73
 None
PCA  A   1 ( 3.7A)
PCA  A   1 ( 4.5A)
PCA  A   1 ( 3.3A)
PCA  A   1 ( 4.8A)
 0.75A 2qakB-5w11A:
undetectable		 2qakB-5w11A:
15.00
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.
2QBM_A_CAMA517_0
(CYTOCHROME P450-CAM)		 2pfy PUTATIVE EXPORTED
PROTEIN
(Bordetella
pertussis) 		4 / 8 PHE A 172
TYR A 195
THR A 182
ILE A 177
 None
None
PCA  A 302 (-3.5A)
None
 0.97A 2qbmA-2pfyA:
undetectable		 2qbmA-2pfyA:
22.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2QMJ_A_ACRA1001_1
(MALTASE-GLUCOAMYLASE
, INTESTINAL)		 1ovw ENDOGLUCANASE I
(Fusarium
oxysporum) 		5 / 12 ASN A 183
ILE A  31
ILE A  85
ALA A 163
HIS A  38
 None
None
None
PCA  A   1 ( 4.3A)
None
 1.47A 2qmjA-1ovwA:
undetectable		 2qmjA-1ovwA:
18.63
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.
2QR2_B_VK3B235_1
(PROTEIN (QUINONE
REDUCTASE TYPE 2))		 1ose PORCINE
ALPHA-AMYLASE
(Sus
scrofa) 		4 / 6 PHE A 231
PHE A 229
GLY A  39
GLY A  38
 None
PCA  A   1 ( 4.4A)
None
None
 0.83A 2qr2A-1oseA:
undetectable
2qr2B-1oseA:
undetectable		 2qr2A-1oseA:
18.53
2qr2B-1oseA:
18.53
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.
2QR2_B_VK3B236_1
(PROTEIN (QUINONE
REDUCTASE TYPE 2))		 1ose PORCINE
ALPHA-AMYLASE
(Sus
scrofa) 		4 / 5 GLY A  39
GLY A  38
PHE A 231
PHE A 229
 None
None
None
PCA  A   1 ( 4.4A)
 0.86A 2qr2A-1oseA:
undetectable
2qr2B-1oseA:
undetectable		 2qr2A-1oseA:
18.53
2qr2B-1oseA:
18.53
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.
2XZ5_A_ACHA1210_0
(SOLUBLE
ACETYLCHOLINE
RECEPTOR)		 3juc AIG2-LIKE
DOMAIN-CONTAINING
PROTEIN 1
(Homo
sapiens) 		4 / 6 TYR A   7
TYR A  88
CYH A  84
TYR A 119
 PCA  A1001 (-3.6A)
PCA  A1001 (-4.6A)
None
None
 1.49A 2xz5A-3jucA:
undetectable
2xz5B-3jucA:
undetectable		 2xz5A-3jucA:
18.92
2xz5B-3jucA:
18.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2Y7P_A_SALA1001_1
(LYSR-TYPE REGULATORY
PROTEIN)		 2a39 ENDOGLUCANASE I
(Humicola
insolens) 		4 / 6 MET A  75
SER A  35
PRO A 162
GLY A 163
 PCA  A   1 ( 4.0A)
None
None
None
 1.42A 2y7pA-2a39A:
0.0		 2y7pA-2a39A:
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.
2ZIF_B_SAMB298_0
(PUTATIVE
MODIFICATION
METHYLASE)		 1q9h CELLOBIOHYDROLASE I
CATALYTIC DOMAIN
(Rasamsonia
emersonii) 		5 / 12 SER A 112
ALA A 160
GLY A 165
THR A 166
LEU A 105
 None
PCA  A   1 ( 3.7A)
None
None
None
 1.21A 2zifB-1q9hA:
undetectable		 2zifB-1q9hA:
18.69
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.
3BGR_A_T27A556_1
(REVERSE
TRANSCRIPTASE/RIBONU
CLEASE H
P51 RT)		 4gft MYOSIN A TAIL DOMAIN
INTERACTING PROTEIN
NANOBODY
(Lama
glama;
Plasmodium
falciparum) 		5 / 11 LEU A 203
VAL B 105
TYR B 115
TYR B  34
LEU A 175
 None
None
PCA  B   2 ( 3.9A)
None
None
 1.08A 3bgrA-4gftA:
undetectable
3bgrB-4gftA:
undetectable		 3bgrA-4gftA:
7.99
3bgrB-4gftA:
9.90
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.
3BJW_F_SVRF509_2
(PHOSPHOLIPASE A2)		 1dtx ALPHA-DENDROTOXIN
(Dendroaspis
angusticeps) 		4 / 8 LYS A   2
TYR A  25
ASN A  26
LYS A  30
 PCA  A   1 ( 2.9A)
None
None
None
 1.42A 3bjwD-1dtxA:
undetectable		 3bjwD-1dtxA:
17.09
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.
3BOG_C_DHIC8_0
(6.5 KDA GLYCINE-RICH
ANTIFREEZE PROTEIN)		 2a39 ENDOGLUCANASE I
(Humicola
insolens) 		3 / 3 SER A  35
GLY A 170
GLY A 184
 None
None
PCA  A   1 ( 3.3A)
 0.45A 3bogA-2a39A:
undetectable
3bogC-2a39A:
undetectable		 3bogA-2a39A:
undetectable
3bogC-2a39A:
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.
3EEY_A_SAMA300_0
(PUTATIVE RRNA
METHYLASE)		 4qi3 CELLOBIOSE
DEHYDROGENASE
(Crassicarpon
hotsonii) 		5 / 12 THR A  19
ASN A   3
GLY A  53
ASN A   6
THR A  34
 None
PCA  A   1 ( 4.5A)
None
None
None
 1.05A 3eeyA-4qi3A:
undetectable		 3eeyA-4qi3A:
16.36
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.
3EEY_B_SAMB300_0
(PUTATIVE RRNA
METHYLASE)		 4qi3 CELLOBIOSE
DEHYDROGENASE
(Crassicarpon
hotsonii) 		5 / 12 THR A  19
ASN A   3
GLY A  53
ASN A   6
THR A  34
 None
PCA  A   1 ( 4.5A)
None
None
None
 1.04A 3eeyB-4qi3A:
undetectable		 3eeyB-4qi3A:
16.36
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.
3EEY_C_SAMC300_0
(PUTATIVE RRNA
METHYLASE)		 4qi3 CELLOBIOSE
DEHYDROGENASE
(Crassicarpon
hotsonii) 		5 / 12 THR A  19
ASN A   3
GLY A  53
ASN A   6
THR A  34
 None
PCA  A   1 ( 4.5A)
None
None
None
 1.04A 3eeyC-4qi3A:
undetectable		 3eeyC-4qi3A:
16.36
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.
3EEY_D_SAMD300_0
(PUTATIVE RRNA
METHYLASE)		 4qi3 CELLOBIOSE
DEHYDROGENASE
(Crassicarpon
hotsonii) 		5 / 12 THR A  19
ASN A   3
GLY A  53
ASN A   6
THR A  34
 None
PCA  A   1 ( 4.5A)
None
None
None
 1.03A 3eeyD-4qi3A:
undetectable		 3eeyD-4qi3A:
16.36
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.
3EEY_E_SAME300_0
(PUTATIVE RRNA
METHYLASE)		 4qi3 CELLOBIOSE
DEHYDROGENASE
(Crassicarpon
hotsonii) 		5 / 12 THR A  19
ASN A   3
GLY A  53
ASN A   6
THR A  34
 None
PCA  A   1 ( 4.5A)
None
None
None
 1.05A 3eeyE-4qi3A:
undetectable		 3eeyE-4qi3A:
16.36
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.
3EEY_H_SAMH300_0
(PUTATIVE RRNA
METHYLASE)		 4qi3 CELLOBIOSE
DEHYDROGENASE
(Crassicarpon
hotsonii) 		5 / 12 THR A  19
ASN A   3
GLY A  53
ASN A   6
THR A  34
 None
PCA  A   1 ( 4.5A)
None
None
None
 1.05A 3eeyH-4qi3A:
undetectable		 3eeyH-4qi3A:
16.36
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.
3EEY_I_SAMI300_0
(PUTATIVE RRNA
METHYLASE)		 4qi3 CELLOBIOSE
DEHYDROGENASE
(Crassicarpon
hotsonii) 		5 / 12 THR A  19
ASN A   3
GLY A  53
ASN A   6
THR A  34
 None
PCA  A   1 ( 4.5A)
None
None
None
 1.04A 3eeyI-4qi3A:
undetectable		 3eeyI-4qi3A:
16.36
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.
3EEY_J_SAMJ300_0
(PUTATIVE RRNA
METHYLASE)		 4qi3 CELLOBIOSE
DEHYDROGENASE
(Crassicarpon
hotsonii) 		5 / 12 THR A  19
ASN A   3
GLY A  53
ASN A   6
THR A  34
 None
PCA  A   1 ( 4.5A)
None
None
None
 1.02A 3eeyJ-4qi3A:
undetectable		 3eeyJ-4qi3A:
16.36
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.
3G8I_A_RO7A1_1
(PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR ALPHA)		 1jae ALPHA-AMYLASE
(Tenebrio
molitor) 		5 / 12 VAL A 223
TYR A  65
ILE A 219
VAL A 163
TYR A 125
 None
None
PCA  A   1 ( 4.6A)
None
None
 1.25A 3g8iA-1jaeA:
0.0		 3g8iA-1jaeA:
18.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3G8I_A_RO7A1_1
(PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR ALPHA)		 1jxk ALPHA-AMYLASE,
SALIVARY
(Homo
sapiens) 		5 / 12 VAL A 234
TYR A  67
ILE A 230
VAL A 175
TYR A 131
 None
None
PCA  A   1 ( 4.5A)
None
None
 1.25A 3g8iA-1jxkA:
0.0		 3g8iA-1jxkA:
18.86
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.
3HGI_A_BEZA284_0
(CATECHOL
1,2-DIOXYGENASE)		 4csi CELLULASE
(Humicola
grisea) 		5 / 12 ASP A  74
VAL A  73
GLY A  75
TYR A  78
HIS A  11
 None
PCA  A   1 ( 4.9A)
None
None
None
 1.30A 3hgiA-4csiA:
undetectable		 3hgiA-4csiA:
20.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3IA4_C_MTXC164_1
(DIHYDROFOLATE
REDUCTASE)		 5cad SM80.1 VICILIN
(Solanum
melongena) 		5 / 12 LEU A 101
PHE A  73
SER A 107
ILE A 109
LEU A 111
 None
PCA  A 403 ( 4.8A)
None
None
None
 1.15A 3ia4C-5cadA:
undetectable		 3ia4C-5cadA:
17.22
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.
3IA4_D_MTXD164_1
(DIHYDROFOLATE
REDUCTASE)		 5cad SM80.1 VICILIN
(Solanum
melongena) 		5 / 12 LEU A 101
PHE A  73
SER A 107
ILE A 109
LEU A 111
 None
PCA  A 403 ( 4.8A)
None
None
None
 1.19A 3ia4D-5cadA:
undetectable		 3ia4D-5cadA:
17.22
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.
3JUS_B_ECLB600_1
(LANOSTEROL 14-ALPHA
DEMETHYLASE)		 1z3v CELLULASE
(Phanerochaete
chrysosporium) 		4 / 8 TYR A 164
THR A 166
GLY A 182
ALA A  68
 None
PCA  A   1 ( 4.9A)
PCA  A   1 ( 3.3A)
PCA  A   1 ( 3.7A)
 0.72A 3jusB-1z3vA:
undetectable		 3jusB-1z3vA:
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.
3LB3_A_4CHA191_0
(DEHALOPEROXIDASE A)		 1lsh LIPOVITELLIN (LV-1N,
LV-1C)
(Ichthyomyzon
unicuspis) 		4 / 6 PHE A 103
PHE A  18
HIS A  55
THR A  63
 None
PCA  A  17 ( 4.9A)
None
None
 1.20A 3lb3A-1lshA:
0.0		 3lb3A-1lshA:
8.81
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.
3NU5_B_478B401_1
(PROTEASE)		 2rfz CELLULOSE
1,4-BETA-CELLOBIOSID
ASE
(Melanocarpus
albomyces) 		5 / 12 GLY A 164
ALA A 163
GLY A 185
VAL A 183
ILE A  71
 None
PCA  A   1 ( 3.6A)
PCA  A   1 ( 2.8A)
None
None
 0.85A 3nu5A-2rfzA:
undetectable		 3nu5A-2rfzA:
13.57
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.
3PEO_F_CU9F301_2
(SOLUBLE
ACETYLCHOLINE
RECEPTOR)		 2pfy PUTATIVE EXPORTED
PROTEIN
(Bordetella
pertussis) 		4 / 6 THR A 149
GLN A 123
TYR A 145
SER A  81
 None
PCA  A 302 (-3.0A)
PCA  A 302 (-3.9A)
None
 0.93A 3peoG-2pfyA:
undetectable		 3peoG-2pfyA:
24.23
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3QXT_B_MTXB2000_1
(ANTI-METHOTREXATE
CDR1-3 GRAFT VHH)		 4gft NANOBODY
(Lama
glama) 		6 / 12 LEU B   5
MET B  36
ARG B  74
VAL B  81
ALA B 100
TYR B 115
 None
None
None
None
None
PCA  B   2 ( 3.9A)
 0.34A 3qxtB-4gftB:
22.5		 3qxtB-4gftB:
66.14
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3QXV_A_MTXA2000_1
(ANTI-METHOTREXATE
CDR1-4 GRAFT VHH)		 4gft NANOBODY
(Lama
glama) 		6 / 12 MET B  36
ARG B  74
ASN B  76
VAL B  81
ALA B 100
TYR B 115
 None
None
None
None
None
PCA  B   2 ( 3.9A)
 0.32A 3qxvA-4gftB:
22.6		 3qxvA-4gftB:
66.93
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3QXV_B_MTXB2000_1
(ANTI-METHOTREXATE
CDR1-4 GRAFT VHH)		 4gft NANOBODY
(Lama
glama) 		5 / 12 MET B  36
ARG B  74
VAL B  81
ALA B 100
TYR B 115
 None
None
None
None
PCA  B   2 ( 3.9A)
 0.35A 3qxvB-4gftB:
22.2		 3qxvB-4gftB:
66.93
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3QXV_D_MTXD2000_1
(ANTI-METHOTREXATE
CDR1-4 GRAFT VHH)		 4gft NANOBODY
(Lama
glama) 		5 / 12 MET B  36
ARG B  74
VAL B  81
ALA B 100
TYR B 115
 None
None
None
None
PCA  B   2 ( 3.9A)
 0.38A 3qxvD-4gftB:
22.0		 3qxvD-4gftB:
66.93
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3QXV_E_MTXE2000_1
(ANTI-METHOTREXATE
CDR1-4 GRAFT VHH)		 4gft NANOBODY
(Lama
glama) 		5 / 12 MET B  36
ARG B  74
VAL B  81
ALA B 100
TYR B 115
 None
None
None
None
PCA  B   2 ( 3.9A)
 0.37A 3qxvE-4gftB:
18.6		 3qxvE-4gftB:
66.93
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.
3RQW_C_ACHC323_0
(ELIC PENTAMERIC
LIGAND GATED ION
CHANNEL FROM ERWINIA
CHRYSANTHEMI)		 4gft MYOSIN A TAIL DOMAIN
INTERACTING PROTEIN
NANOBODY
(Plasmodium
falciparum;
Lama
glama) 		4 / 8 PHE B  31
TYR B  34
GLU A 179
GLU B  28
 None
None
PCA  B   2 ( 3.7A)
None
 1.07A 3rqwC-4gftB:
2.5
3rqwD-4gftB:
undetectable		 3rqwC-4gftB:
17.38
3rqwD-4gftB:
17.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3SU9_A_ACTA426_0
(UDP-N-ACETYLGLUCOSAM
INE
1-CARBOXYVINYLTRANSF
ERASE)		 5drn FAB HPU24 HEAVY
CHAIN
(Oryctolagus
cuniculus) 		3 / 3 GLN A   3
GLU A   2
LYS A   2
 PCA  A   1 ( 4.5A)
None
PCA  A   1 ( 3.2A)
 1.19A 3su9A-5drnA:
undetectable		 3su9A-5drnA:
21.31
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.
3UZZ_B_ASDB501_1
(3-OXO-5-BETA-STEROID
4-DEHYDROGENASE)		 2ciy CHLOROPEROXIDASE
(Leptoxyphium
fumago) 		4 / 8 TYR A  40
TYR A 221
LEU A 190
TRP A 225
 None
PCA  A   0 ( 4.7A)
HEM  A 396 ( 4.3A)
None
 1.39A 3uzzB-2ciyA:
undetectable		 3uzzB-2ciyA:
21.56
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3W9T_F_W9TF512_1
(HEMOLYTIC LECTIN
CEL-III)		 1vcl HEMOLYTIC LECTIN
CEL-III
(Cucumaria
echinata) 		4 / 6 THR A   5
GLY A  50
ASP A  51
ILE A  84
 None
None
PCA  A   1 ( 4.6A)
PCA  A   1 ( 4.9A)
 0.44A 3w9tF-1vclA:
36.7		 3w9tF-1vclA:
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.
4D1Y_A_RBFA1176_1
(PUTATIVE PROTEASE I)		 2yok EXOGLUCANASE 1
(Trichoderma
harzianum) 		4 / 8 ASN A 174
LYS A  61
ASN A  86
THR A  60
 PCA  A  18 ( 3.6A)
None
None
None
 1.41A 4d1yA-2yokA:
undetectable
4d1yB-2yokA:
undetectable		 4d1yA-2yokA:
18.38
4d1yB-2yokA:
18.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4EJJ_C_NCTC501_1
(CYTOCHROME P450 2A6)		 1jxk ALPHA-AMYLASE,
SALIVARY
(Homo
sapiens) 		4 / 5 PHE A 229
PHE A 330
ILE A  13
GLY A  38
 PCA  A   1 ( 4.7A)
None
None
None
 1.01A 4ejjC-1jxkA:
undetectable		 4ejjC-1jxkA:
21.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4F84_A_SAMA501_0
(GERANYL DIPHOSPHATE
2-C-METHYLTRANSFERAS
E)		 4ydl HEAVY CHAIN OF
ANTIBODY
C38-VRC18.02
LIGHT CHAIN OF
ANTIBODY
C38-VRC18.02
(Homo
sapiens;
Homo
sapiens) 		5 / 12 HIS H  35
GLY H  95
LEU L  46
GLN L  89
VAL H   2
 None
None
None
None
PCA  H   1 ( 3.3A)
 1.17A 4f84A-4ydlH:
undetectable		 4f84A-4ydlH:
21.30
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.
4G1B_B_ECNB403_1
(FLAVOHEMOGLOBIN)		 4xt1 FRACTALKINE
G-PROTEIN COUPLED
RECEPTOR HOMOLOG
US28
(Cytomegalovirus;
Homo
sapiens) 		5 / 11 THR A 108
PHE A 111
TYR A 112
THR B   6
TYR A  40
 PCA  B   1 ( 3.8A)
None
None
None
None
 1.06A 4g1bB-4xt1A:
undetectable		 4g1bB-4xt1A:
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.
4KSZ_A_CYSA620_0
(LACTOPEROXIDASE)		 4yaq PG9_N100FY FAB HEAVY
CHAIN
(Homo
sapiens) 		3 / 3 ARG H  94
GLU H  95
PHE H  50
 PCA  H   2 (-4.0A)
None
None
 1.02A 4kszA-4yaqH:
undetectable		 4kszA-4yaqH:
17.98
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4M7K_H_ACTH302_0
(10H10 HEAVY CHAIN)		 3qpq C1068 HEAVY CHAIN
(Homo
sapiens;
Mus
musculus) 		4 / 5 VAL H   2
TYR H  27
ARG H  98
TYR H 108
 PCA  H   1 ( 3.4A)
None
None
None
 0.25A 4m7kH-3qpqH:
23.4		 4m7kH-3qpqH:
80.35
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4M7K_H_ACTH302_0
(10H10 HEAVY CHAIN)		 4f33 MORAB-009 FAB HEAVY
CHAIN
(Mus
musculus) 		4 / 5 VAL B   2
TYR B  27
ARG B  98
TYR B 108
 PCA  B   1 ( 3.3A)
None
None
None
 0.21A 4m7kH-4f33B:
30.4		 4m7kH-4f33B:
81.22
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4M7K_H_ACTH302_0
(10H10 HEAVY CHAIN)		 5iwl 5F9 DIABODY
(Homo
sapiens) 		4 / 5 VAL B   2
TYR B  27
ARG B  98
TYR B 106
 PCA  B   1 ( 3.3A)
None
None
None
 0.33A 4m7kH-5iwlB:
22.1		 4m7kH-5iwlB:
43.15
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4M7K_H_ACTH302_0
(10H10 HEAVY CHAIN)		 5kvd ZV-2 ANTIBODY FAB
HEAVY CHAIN
(Mus
musculus) 		4 / 5 VAL H   2
TYR H  27
ARG H  94
TYR H 102
 PCA  H   1 ( 3.3A)
None
None
None
 0.27A 4m7kH-5kvdH:
23.1		 4m7kH-5kvdH:
71.56
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4M7K_H_ACTH302_0
(10H10 HEAVY CHAIN)		 5myx FAB C#24 HEAVY CHAIN
(Mus
musculus) 		4 / 5 VAL B   2
TYR B  27
ARG B  98
TYR B 104
 PCA  B   1 ( 3.3A)
None
None
None
 0.20A 4m7kH-5myxB:
28.5		 4m7kH-5myxB:
63.39
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4M7K_H_ACTH302_0
(10H10 HEAVY CHAIN)		 5ngv ANTI-HUMAN ACTRIIB
MAB BYM338
HEAVY-CHAIN
(Homo
sapiens) 		4 / 5 VAL H   2
TYR H  27
ARG H  98
TYR H 104
 PCA  H   1 ( 3.4A)
None
None
None
 0.32A 4m7kH-5ngvH:
22.3		 4m7kH-5ngvH:
36.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4M7K_H_ACTH302_0
(10H10 HEAVY CHAIN)		 5w5x 3C10 FAB' HEAVY
CHAIN
(Rattus
norvegicus) 		4 / 5 VAL H   2
TYR H  27
ARG H  98
TYR H 107
 PCA  H   1 ( 3.3A)
None
None
None
 0.34A 4m7kH-5w5xH:
23.8		 4m7kH-5w5xH:
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.
4M7K_H_ACTH302_0
(10H10 HEAVY CHAIN)		 6h0e -
(-) 		4 / 5 VAL H   2
TYR H  27
ARG H  98
TYR H 110
 PCA  H   1 ( 3.3A)
None
None
None
 0.23A 4m7kH-6h0eH:
22.1		 4m7kH-6h0eH:
undetectable
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4MBS_A_MRVA1101_2
(CHIMERA PROTEIN OF
C-C CHEMOKINE
RECEPTOR TYPE 5 AND
RUBREDOXIN)		 5uiw C-C CHEMOKINE
RECEPTOR TYPE
5,RUBREDOXIN CHIMERA
(Clostridium
pasteurianum;
Homo
sapiens) 		6 / 7 TYR A  89
GLN A 194
THR A 195
LEU A 255
THR A 259
THR A 284
 None
None
PCA  B   0 ( 4.3A)
None
None
OLC  A1107 ( 4.3A)
 0.63A 4mbsA-5uiwA:
39.8		 4mbsA-5uiwA:
99.28
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4MBS_A_MRVA1101_2
(CHIMERA PROTEIN OF
C-C CHEMOKINE
RECEPTOR TYPE 5 AND
RUBREDOXIN)		 5uiw C-C CHEMOKINE
RECEPTOR TYPE
5,RUBREDOXIN CHIMERA
(Clostridium
pasteurianum;
Homo
sapiens) 		5 / 7 TYR A  89
THR A 195
THR A 259
THR A 284
MET A 287
 None
PCA  B   0 ( 4.3A)
None
OLC  A1107 ( 4.3A)
None
 0.99A 4mbsA-5uiwA:
39.8		 4mbsA-5uiwA:
99.28
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4MBS_B_MRVB1101_2
(CHIMERA PROTEIN OF
C-C CHEMOKINE
RECEPTOR TYPE 5 AND
RUBREDOXIN)		 5uiw C-C CHEMOKINE
RECEPTOR TYPE
5,RUBREDOXIN CHIMERA
(Clostridium
pasteurianum;
Homo
sapiens) 		4 / 5 TYR A  89
THR A 195
LEU A 255
THR A 284
 None
PCA  B   0 ( 4.3A)
None
OLC  A1107 ( 4.3A)
 0.62A 4mbsB-5uiwA:
41.1		 4mbsB-5uiwA:
99.28
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.
4OBW_C_SAMC601_0
(2-METHOXY-6-POLYPREN
YL-1,4-BENZOQUINOL
METHYLASE,
MITOCHONDRIAL)		 5w11 GLUCANASE
(Thermothelomyces
thermophila) 		5 / 12 GLY A 161
SER A 160
ILE A 184
ASN A 185
SER A  69
 PCA  A   1 ( 4.8A)
None
None
None
None
 1.09A 4obwC-5w11A:
undetectable		 4obwC-5w11A:
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.
4QB9_A_PARA500_1
(ENHANCED
INTRACELLULAR
SURVIVAL PROTEIN)		 2rfz CELLULOSE
1,4-BETA-CELLOBIOSID
ASE
(Melanocarpus
albomyces) 		5 / 10 SER A 160
GLU A 151
ASP A 115
TYR A 235
GLY A 154
 PCA  A   1 ( 4.3A)
None
None
None
None
 1.38A 4qb9A-2rfzA:
0.0		 4qb9A-2rfzA:
21.31
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.
4RP8_C_ASCC501_0
(ASCORBATE-SPECIFIC
PERMEASE IIC
COMPONENT ULAA)		 5cad SM80.1 VICILIN
(Solanum
melongena) 		5 / 12 ILE A 109
HIS A  65
ILE A  54
PHE A  30
MET A  62
 None
PCA  A 403 (-3.9A)
None
PCA  A 403 (-4.1A)
PCA  A 403 ( 4.9A)
 1.05A 4rp8C-5cadA:
undetectable		 4rp8C-5cadA:
21.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4RVD_A_SAMA502_0
(D-MYCAROSE
3-C-METHYLTRANSFERAS
E)		 1z5f RC-RNASE 3
(Rana
catesbeiana) 		5 / 12 ILE A  86
GLY A 100
HIS A  97
HIS A  10
ILE A  37
 None
None
PCA  A   1 ( 4.9A)
None
None
 1.11A 4rvdA-1z5fA:
undetectable		 4rvdA-1z5fA:
13.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4X1K_D_LOCD502_1
(TUBULIN ALPHA CHAIN
TUBULIN BETA CHAIN)		 2yg1 CELLULOSE
1,4-BETA-CELLOBIOSID
ASE
(Heterobasidion
annosum) 		4 / 4 ASN A 163
SER A 167
ALA A 165
VAL A   3
 PCA  A   1 (-3.6A)
None
PCA  A   1 ( 3.6A)
None
 1.26A 4x1kC-2yg1A:
undetectable		 4x1kC-2yg1A:
19.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4YIA_B_IMNB401_1
(THYROXINE-BINDING
GLOBULIN)		 6cjk -
(-) 		5 / 10 SER B  31
SER B  30
LEU B 102
LEU B   4
SER B  74
 None
None
PCA  B   3 ( 4.5A)
PCA  B   3 ( 3.7A)
None
 1.15A 4yiaA-6cjkB:
undetectable		 4yiaA-6cjkB:
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.
4Z4G_A_IPHA902_0
(PROTEIN ARGONAUTE-2)		 2ljs TRYPSIN INHIBITOR 3
(Momordica
cochinchinensis) 		4 / 7 CSS A  21
ILE A  22
PRO A   5
ILE A   7
 None
PCA  A   1 ( 4.9A)
None
None
 0.96A 4z4gA-2ljsA:
undetectable		 4z4gA-2ljsA:
3.27
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.
4ZJ8_A_SUVA2001_2
(HUMAN OX1R FUSION
PROTEIN TO P.ABYSII
GLYCOGEN SYNTHASE)		 5cad SM80.1 VICILIN
(Solanum
melongena) 		4 / 6 ILE A  72
HIS A  65
ILE A  84
VAL A 208
 None
PCA  A 403 (-3.9A)
None
None
 0.79A 4zj8A-5cadA:
undetectable		 4zj8A-5cadA:
19.10
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.
5AYF_A_C7HA402_1
(HISTONE-LYSINE
N-METHYLTRANSFERASE
SETD7)		 5uiw C-C CHEMOKINE
RECEPTOR TYPE
5,RUBREDOXIN CHIMERA
C-C MOTIF CHEMOKINE
5
(Clostridium
pasteurianum;
Homo
sapiens) 		4 / 5 TYR A 251
GLY B   1
TYR A 108
GLY A 111
 None
PCA  B   0 ( 2.4A)
None
None
 0.94A 5ayfA-5uiwA:
undetectable		 5ayfA-5uiwA:
19.18
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.
5E3I_A_HISA502_0
(HISTIDINE--TRNA
LIGASE)		 1ovw ENDOGLUCANASE I
(Fusarium
oxysporum) 		5 / 12 TYR A 117
GLY A 153
TYR A 108
GLY A 170
ALA A 163
 None
None
None
None
PCA  A   1 ( 4.3A)
 1.19A 5e3iA-1ovwA:
undetectable		 5e3iA-1ovwA:
21.66
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.
5E3I_B_HISB502_0
(HISTIDINE--TRNA
LIGASE)		 1ovw ENDOGLUCANASE I
(Fusarium
oxysporum) 		5 / 11 TYR A 117
GLY A 153
TYR A 108
GLY A 170
ALA A 163
 None
None
None
None
PCA  A   1 ( 4.3A)
 1.20A 5e3iB-1ovwA:
undetectable		 5e3iB-1ovwA:
21.66
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.
5ESK_A_1YNA701_1
(LANOSTEROL 14-ALPHA
DEMETHYLASE)		 2yok EXOGLUCANASE 1
(Trichoderma
harzianum) 		5 / 12 GLY A 166
LEU A 121
TYR A 431
GLY A 118
THR A 182
 None
None
None
None
PCA  A  18 ( 4.9A)
 1.09A 5eskA-2yokA:
undetectable		 5eskA-2yokA:
21.10
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.
5HWK_A_BEZA301_0
(GLUTATHIONE-SPECIFIC
GAMMA-GLUTAMYLCYCLOT
RANSFERASE)		 3juc AIG2-LIKE
DOMAIN-CONTAINING
PROTEIN 1
(Homo
sapiens) 		5 / 10 TYR A   7
GLY A   8
LEU A  10
TYR A  88
TYR A 119
 PCA  A1001 (-3.6A)
PCA  A1001 (-3.1A)
PCA  A1001 (-3.7A)
PCA  A1001 (-4.6A)
None
 0.77A 5hwkA-3jucA:
6.7		 5hwkA-3jucA:
22.22
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.
5HWK_B_BEZB301_0
(GLUTATHIONE-SPECIFIC
GAMMA-GLUTAMYLCYCLOT
RANSFERASE)		 3juc AIG2-LIKE
DOMAIN-CONTAINING
PROTEIN 1
(Homo
sapiens) 		5 / 10 TYR A   7
GLY A   8
LEU A  10
TYR A  88
TYR A 119
 PCA  A1001 (-3.6A)
PCA  A1001 (-3.1A)
PCA  A1001 (-3.7A)
PCA  A1001 (-4.6A)
None
 0.78A 5hwkB-3jucA:
6.6		 5hwkB-3jucA:
22.22
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.
5IGJ_A_CTYA402_2
(MACROLIDE
2'-PHOSPHOTRANSFERAS
E)		 4v20 CELLOBIOHYDROLASE
(Aspergillus
fumigatus) 		4 / 5 PRO A 177
HIS A 206
LEU A  73
TYR A  51
 None
None
PCA  A   1 ( 4.5A)
None
 1.47A 5igjA-4v20A:
undetectable		 5igjA-4v20A:
21.90
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.
5L1F_A_6ZPA902_1
(GLUTAMATE RECEPTOR 2)		 1sch PEANUT PEROXIDASE,
MAJOR CATIONIC
ISOZYME
(Arachis
hypogaea) 		4 / 8 SER A  96
ASP A  99
PHE A   6
SER A   3
 None
None
None
PCA  A   1 ( 4.3A)
 1.10A 5l1fA-1schA:
undetectable
5l1fB-1schA:
undetectable		 5l1fA-1schA:
16.14
5l1fB-1schA:
16.14
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.
5NKN_A_LOCA201_2
(NEUTROPHIL
GELATINASE-ASSOCIATE
D LIPOCALIN)		 2a39 ENDOGLUCANASE I
(Humicola
insolens) 		3 / 3 VAL A  66
LYS A   2
MET A  75
 None
None
PCA  A   1 ( 4.0A)
 0.84A 5nknA-2a39A:
undetectable		 5nknA-2a39A:
11.42
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.
5OV9_A_CVIA609_0
(ACETYLCHOLINESTERASE)		 2ciy CHLOROPEROXIDASE
(Leptoxyphium
fumago) 		4 / 6 TYR A 221
ASP A 208
TRP A 225
TYR A  10
 PCA  A   0 ( 4.7A)
None
None
None
 1.40A 5ov9A-2ciyA:
undetectable		 5ov9A-2ciyA:
20.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5OV9_B_CVIB603_0
(ACETYLCHOLINESTERASE)		 2ciy CHLOROPEROXIDASE
(Leptoxyphium
fumago) 		4 / 7 TYR A 221
ASP A 208
TRP A 225
TYR A  10
 PCA  A   0 ( 4.7A)
None
None
None
 1.44A 5ov9B-2ciyA:
undetectable		 5ov9B-2ciyA:
20.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6FBN_B_SAMB401_0
(S-ADENOSYLMETHIONINE
SYNTHASE ISOFORM
TYPE-2)		 4xuy PROBABLE
ENDO-1,4-BETA-XYLANA
SE C
(Aspergillus
niger) 		4 / 7 ALA A 324
ASP A 311
ASP A  65
ILE A  61
 None
None
PCA  A  26 ( 4.2A)
PCA  A  26 ( 4.5A)
 0.97A 6fbnA-4xuyA:
undetectable		 6fbnA-4xuyA:
22.36
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.
6I0Y_A_TRPA3001_0
(23S RIBOSOMAL RNA
TRYPTOPHANASE OPERON
LEADER PEPTIDE)		 4haq GH7 FAMILY PROTEIN
(Limnoria
quadripunctata) 		3 / 3 TRP A  57
ILE A  90
ASP A  91
 None
PCA  A  23 ( 4.2A)
None
 0.60A 6i0y7-4haqA:
undetectable		 6i0y7-4haqA:
5.90
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.
6I0Y_A_TRPA3001_0
(23S RIBOSOMAL RNA
TRYPTOPHANASE OPERON
LEADER PEPTIDE)		 5mch CELLOBIOHYDROLASE
CHBI
(Daphnia
pulex) 		3 / 3 TRP A  59
ILE A  92
ASP A  93
 None
PCA  A  20 ( 4.1A)
None
 0.59A 6i0y7-5mchA:
undetectable		 6i0y7-5mchA:
4.28
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.
6I0Y_A_TRPA3001_0
(23S RIBOSOMAL RNA
TRYPTOPHANASE OPERON
LEADER PEPTIDE)		 5w11 GLUCANASE
(Thermothelomyces
thermophila) 		3 / 3 TRP A  40
ILE A  73
ASP A  74
 None
PCA  A   1 ( 4.8A)
None
 0.59A 6i0y7-5w11A:
undetectable		 6i0y7-5w11A:
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.
6NJ9_K_SAMK500_0
(HISTONE-LYSINE
N-METHYLTRANSFERASE,
H3 LYSINE-79
SPECIFIC)		 1q2e EXOCELLOBIOHYDROLASE
I
(Trichoderma
reesei) 		5 / 12 GLY A 185
ASP A 150
GLY A 153
GLY A 170
ALA A  36
 PCA  A   1 ( 3.3A)
None
None
None
None
 1.08A 6nj9K-1q2eA:
undetectable		 6nj9K-1q2eA:
20.17
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.
6NJ9_K_SAMK500_0
(HISTONE-LYSINE
N-METHYLTRANSFERASE,
H3 LYSINE-79
SPECIFIC)		 4zzp CELLULOSE
1,4-BETA-CELLOBIOSID
ASE
(Dictyostelium
purpureum) 		5 / 12 GLY A 184
ASP A 149
GLY A 152
GLY A 169
ALA A  36
 PCA  A   1 ( 3.3A)
None
None
None
None
 1.08A 6nj9K-4zzpA:
undetectable		 6nj9K-4zzpA:
21.23