SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '212'


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.
11GS_A_EAAA211_1
(GLUTATHIONE
S-TRANSFERASE)		 2hp3 IDS-EPIMERASE
(Agrobacterium
tumefaciens) 		4 / 7 PHE A 371
VAL A 306
ILE A 393
GLY A 373
 None
None
None
UNX  A1212 ( 3.6A)
 0.96A 11gsA-2hp3A:
undetectable		 11gsA-2hp3A:
18.30
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.
1CEB_B_AMHB90_1
(PLASMINOGEN)		 5dz2 GERMACRADIENOL/GEOSM
IN SYNTHASE
(Streptomyces
coelicolor) 		4 / 7 ASP A  55
TRP A 319
TYR A 326
ARG A 236
 None
None
212  A 404 (-4.3A)
212  A 404 (-3.1A)
 1.49A 1cebB-5dz2A:
undetectable		 1cebB-5dz2A:
17.00
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.
1DB1_A_VDXA428_1
(VITAMIN D NUCLEAR
RECEPTOR)		 2wdu GLUTATHIONE
TRANSFERASE SIGMA
CLASS
(Fasciola
hepatica) 		5 / 12 TYR A  93
LEU A 135
LEU A 138
VAL A 139
SER A 142
 DMS  A1212 ( 4.7A)
None
None
None
None
 1.04A 1db1A-2wduA:
undetectable		 1db1A-2wduA:
23.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1IBG_H_OBNH1_1
(IGG2B-KAPPA 40-50
FAB (HEAVY CHAIN))		 2bv7 GLYCOLIPID TRANSFER
PROTEIN
(Bos
taurus) 		4 / 6 HIS A 140
LEU A 136
PHE A 148
VAL A 144
 GM3  A1212 (-3.6A)
GM3  A1212 (-4.3A)
GM3  A1212 (-4.6A)
None
 1.02A 1ibgH-2bv7A:
undetectable		 1ibgH-2bv7A:
21.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1IE9_A_VDXA500_1
(VITAMIN D3 RECEPTOR)		 2wdu GLUTATHIONE
TRANSFERASE SIGMA
CLASS
(Fasciola
hepatica) 		5 / 12 TYR A  93
LEU A 135
LEU A 138
VAL A 139
SER A 142
 DMS  A1212 ( 4.7A)
None
None
None
None
 1.09A 1ie9A-2wduA:
undetectable		 1ie9A-2wduA:
23.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1MX1_A_THAA1_1
(LIVER
CARBOXYLESTERASE I)		 1u60 PROBABLE GLUTAMINASE
YBAS
(Escherichia
coli) 		5 / 11 LEU A 205
GLY A 265
GLY A 264
LEU A 283
LEU A  64
 None
None
None
FMT  A1212 ( 4.5A)
None
 0.73A 1mx1A-1u60A:
undetectable		 1mx1A-1u60A:
21.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1MX1_D_THAD4_1
(LIVER
CARBOXYLESTERASE I)		 1u60 PROBABLE GLUTAMINASE
YBAS
(Escherichia
coli) 		5 / 12 LEU A 205
GLY A 265
GLY A 264
LEU A 283
LEU A  64
 None
None
None
FMT  A1212 ( 4.5A)
None
 0.74A 1mx1D-1u60A:
undetectable		 1mx1D-1u60A:
21.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1N4F_A_ASRA140_0
(LYSOZYME C)		 5fre EXO-ALPHA-SIALIDASE
(Clostridium
perfringens) 		3 / 3 ASN A 152
ALA A  17
ASN A 161
 CA  A 212 (-3.3A)
None
None
 0.82A 1n4fA-5freA:
undetectable		 1n4fA-5freA:
20.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1OS2_A_HAEA874_1
(MACROPHAGE
METALLOELASTASE)		 3lmc PEPTIDASE,
ZINC-DEPENDENT
(Methanocorpuscul
um
labreanum) 		4 / 5 HIS A 149
GLU A 150
HIS A 153
HIS A 159
 ZN  A 212 (-3.4A)
ZN  A 212 ( 4.3A)
ZN  A 212 (-3.4A)
ZN  A 212 (-3.3A)
 0.26A 1os2A-3lmcA:
5.5		 1os2A-3lmcA:
23.66
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.
1OS2_D_HAED574_1
(MACROPHAGE
METALLOELASTASE)		 3lmc PEPTIDASE,
ZINC-DEPENDENT
(Methanocorpuscul
um
labreanum) 		4 / 4 HIS A 149
GLU A 150
HIS A 153
HIS A 159
 ZN  A 212 (-3.4A)
ZN  A 212 ( 4.3A)
ZN  A 212 (-3.4A)
ZN  A 212 (-3.3A)
 0.25A 1os2D-3lmcA:
5.8		 1os2D-3lmcA:
23.66
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.
1P9G_A_ACTA42_0
(EAFP 2)		 5xyi 40S RIBOSOMAL
PROTEIN S29,
PUTATIVE
(Trichomonas
vaginalis) 		3 / 3 CYH d  43
ARG d  47
CYH d  22
 G  21242 ( 3.9A)
G  21242 ( 4.7A)
None
 1.32A 1p9gA-5xyid:
undetectable		 1p9gA-5xyid:
25.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1Q23_C_FUAC701_1
(CHLORAMPHENICOL
ACETYLTRANSFERASE)		 2vbf BRANCHED-CHAIN
ALPHA-KETOACID
DECARBOXYLASE
(Lactococcus
lactis) 		4 / 4 ALA A 212
VAL A 246
ALA A 245
HIS A 214
 ALA  A 212 ( 0.0A)
VAL  A 246 ( 0.6A)
ALA  A 245 ( 0.0A)
HIS  A 214 ( 1.0A)
 1.13A 1q23A-2vbfA:
undetectable		 1q23A-2vbfA:
15.76
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.
1Q23_E_FUAE706_2
(CHLORAMPHENICOL
ACETYLTRANSFERASE)		 2vbf BRANCHED-CHAIN
ALPHA-KETOACID
DECARBOXYLASE
(Lactococcus
lactis) 		4 / 4 ALA A 212
VAL A 246
ALA A 245
HIS A 214
 ALA  A 212 ( 0.0A)
VAL  A 246 ( 0.6A)
ALA  A 245 ( 0.0A)
HIS  A 214 ( 1.0A)
 1.20A 1q23F-2vbfA:
undetectable		 1q23F-2vbfA:
15.76
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.
1QU2_A_MRCA1993_2
(ISOLEUCYL-TRNA
SYNTHETASE)		 5xxu RIBOSOMAL PROTEIN
US5
(Toxoplasma
gondii) 		3 / 3 GLU C  67
TRP C  37
LYS C 127
 None
None
U  21285 ( 3.1A)
 1.41A 1qu2A-5xxuC:
undetectable		 1qu2A-5xxuC:
14.77
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.
1SQ5_B_PAUB6003_0
(PANTOTHENATE KINASE)		 1u60 PROBABLE GLUTAMINASE
YBAS
(Escherichia
coli) 		5 / 10 LEU A 283
GLY A 263
TYR A 244
LEU A  33
ILE A  67
 FMT  A1212 ( 4.5A)
None
None
None
None
 1.35A 1sq5B-1u60A:
undetectable		 1sq5B-1u60A:
19.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1TMX_B_BEZB882_0
(HYDROXYQUINOL
1,2-DIOXYGENASE)		 3uss PUTATIVE
UNCHARACTERIZED
PROTEIN
(Pseudomonas
aeruginosa) 		5 / 12 LEU A 126
TYR A 159
ILE A  97
HIS A  91
HIS A  89
 None
SO4  A 215 (-4.6A)
None
FE2  A 212 ( 3.2A)
FE2  A 212 ( 3.2A)
 1.33A 1tmxB-3ussA:
undetectable		 1tmxB-3ussA:
23.39
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.
1UTT_A_HAEA1265_1
(MACROPHAGE
METALLOELASTASE)		 3lmc PEPTIDASE,
ZINC-DEPENDENT
(Methanocorpuscul
um
labreanum) 		4 / 4 HIS A 149
GLU A 150
HIS A 153
HIS A 159
 ZN  A 212 (-3.4A)
ZN  A 212 ( 4.3A)
ZN  A 212 (-3.4A)
ZN  A 212 (-3.3A)
 0.27A 1uttA-3lmcA:
8.1		 1uttA-3lmcA:
22.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1UTZ_A_HAEA1267_1
(MACROPHAGE
METALLOELASTASE)		 3lmc PEPTIDASE,
ZINC-DEPENDENT
(Methanocorpuscul
um
labreanum) 		4 / 4 HIS A 149
GLU A 150
HIS A 153
HIS A 159
 ZN  A 212 (-3.4A)
ZN  A 212 ( 4.3A)
ZN  A 212 (-3.4A)
ZN  A 212 (-3.3A)
 0.29A 1utzA-3lmcA:
8.1		 1utzA-3lmcA:
22.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1UTZ_B_HAEB1266_1
(MACROPHAGE
METALLOELASTASE)		 3lmc PEPTIDASE,
ZINC-DEPENDENT
(Methanocorpuscul
um
labreanum) 		4 / 4 HIS A 149
GLU A 150
HIS A 153
HIS A 159
 ZN  A 212 (-3.4A)
ZN  A 212 ( 4.3A)
ZN  A 212 (-3.4A)
ZN  A 212 (-3.3A)
 0.28A 1utzB-3lmcA:
8.1		 1utzB-3lmcA:
22.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1UUJ_B_ACTB1077_0
(PLATELET-ACTIVATING
FACTOR
ACETYLHYDROLASE IB
ALPHA SUBUNIT)		 6fai ESSENTIAL NUCLEAR
PROTEIN 1
(Saccharomyces
cerevisiae) 		3 / 3 ARG i 305
TYR i 260
LYS i 264
 C  21216 ( 3.7A)
None
C  21216 ( 4.8A)
 0.96A 1uujB-6faii:
undetectable		 1uujB-6faii:
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.
1XL6_B_SPMB3001_1
(INWARD RECTIFIER
POTASSIUM CHANNEL)		 3qz5 CO-TYPE NITRILE
HYDRATASE ALPHA
SUBUNIT
(Pseudomonas
putida) 		4 / 5 ALA A 132
TYR A 135
ALA A 128
TYR A 130
 GOL  A 212 ( 3.8A)
None
None
None
 0.95A 1xl6A-3qz5A:
undetectable
1xl6B-3qz5A:
undetectable		 1xl6A-3qz5A:
23.29
1xl6B-3qz5A:
23.29
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1XMU_A_ROFA101_0
(CAMP-SPECIFIC
3',5'-CYCLIC
PHOSPHODIESTERASE 4B)		 1soj CGMP-INHIBITED
3',5'-CYCLIC
PHOSPHODIESTERASE B
(Homo
sapiens) 		5 / 12 HIS A 737
ASP A 937
PRO A 941
SER A 990
PHE A 991
 IBM  A2111 ( 4.8A)
MG  A2123 (-2.5A)
None
None
IBM  A2111 (-3.6A)
 1.24A 1xmuA-1sojA:
41.8		 1xmuA-1sojA:
30.21
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1XMU_A_ROFA101_0
(CAMP-SPECIFIC
3',5'-CYCLIC
PHOSPHODIESTERASE 4B)		 1soj CGMP-INHIBITED
3',5'-CYCLIC
PHOSPHODIESTERASE B
(Homo
sapiens) 		8 / 12 TYR A 736
HIS A 737
ASP A 937
PRO A 941
TRP A 951
ILE A 955
PHE A 959
PHE A 991
 IBM  A2111 (-4.5A)
IBM  A2111 ( 4.8A)
MG  A2123 (-2.5A)
None
None
IBM  A2111 (-4.2A)
None
IBM  A2111 (-3.6A)
 0.57A 1xmuA-1sojA:
41.8		 1xmuA-1sojA:
30.21
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1XMU_B_ROFB102_0
(CAMP-SPECIFIC
3',5'-CYCLIC
PHOSPHODIESTERASE 4B)		 1soj CGMP-INHIBITED
3',5'-CYCLIC
PHOSPHODIESTERASE B
(Homo
sapiens) 		7 / 12 TYR A 736
HIS A 737
ASP A 937
PRO A 941
TRP A 951
ILE A 955
PHE A 959
 IBM  A2111 (-4.5A)
IBM  A2111 ( 4.8A)
MG  A2123 (-2.5A)
None
None
IBM  A2111 (-4.2A)
None
 0.48A 1xmuB-1sojA:
41.8		 1xmuB-1sojA:
30.21
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1XOM_A_CIOA603_1
(CAMP-SPECIFIC
3',5'-CYCLIC
PHOSPHODIESTERASE 4D)		 1soj CGMP-INHIBITED
3',5'-CYCLIC
PHOSPHODIESTERASE B
(Homo
sapiens) 		7 / 12 TYR A 736
HIS A 737
ASP A 937
ILE A 955
PHE A 959
GLN A 988
PHE A 991
 IBM  A2111 (-4.5A)
IBM  A2111 ( 4.8A)
MG  A2123 (-2.5A)
IBM  A2111 (-4.2A)
None
IBM  A2111 (-3.3A)
IBM  A2111 (-3.6A)
 0.54A 1xomA-1sojA:
42.2		 1xomA-1sojA:
31.99
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1XOQ_A_ROFA502_0
(CAMP-SPECIFIC
3',5'-CYCLIC
PHOSPHODIESTERASE 4D)		 1soj CGMP-INHIBITED
3',5'-CYCLIC
PHOSPHODIESTERASE B
(Homo
sapiens) 		5 / 12 HIS A 737
ASP A 937
PRO A 941
SER A 990
PHE A 991
 IBM  A2111 ( 4.8A)
MG  A2123 (-2.5A)
None
None
IBM  A2111 (-3.6A)
 1.24A 1xoqA-1sojA:
42.0		 1xoqA-1sojA:
31.99
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1XOQ_A_ROFA502_0
(CAMP-SPECIFIC
3',5'-CYCLIC
PHOSPHODIESTERASE 4D)		 1soj CGMP-INHIBITED
3',5'-CYCLIC
PHOSPHODIESTERASE B
(Homo
sapiens) 		7 / 12 TYR A 736
HIS A 737
ASP A 937
PRO A 941
THR A 952
ILE A 955
PHE A 991
 IBM  A2111 (-4.5A)
IBM  A2111 ( 4.8A)
MG  A2123 (-2.5A)
None
IBM  A2111 ( 4.8A)
IBM  A2111 (-4.2A)
IBM  A2111 (-3.6A)
 0.52A 1xoqA-1sojA:
42.0		 1xoqA-1sojA:
31.99
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1XOQ_B_ROFB501_0
(CAMP-SPECIFIC
3',5'-CYCLIC
PHOSPHODIESTERASE 4D)		 1soj CGMP-INHIBITED
3',5'-CYCLIC
PHOSPHODIESTERASE B
(Homo
sapiens) 		5 / 12 HIS A 737
ASP A 937
PRO A 941
SER A 990
PHE A 991
 IBM  A2111 ( 4.8A)
MG  A2123 (-2.5A)
None
None
IBM  A2111 (-3.6A)
 1.25A 1xoqB-1sojA:
42.2		 1xoqB-1sojA:
31.99
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1XOQ_B_ROFB501_0
(CAMP-SPECIFIC
3',5'-CYCLIC
PHOSPHODIESTERASE 4D)		 1soj CGMP-INHIBITED
3',5'-CYCLIC
PHOSPHODIESTERASE B
(Homo
sapiens) 		8 / 12 TYR A 736
HIS A 737
ASP A 937
PRO A 941
TRP A 951
THR A 952
ILE A 955
PHE A 991
 IBM  A2111 (-4.5A)
IBM  A2111 ( 4.8A)
MG  A2123 (-2.5A)
None
None
IBM  A2111 ( 4.8A)
IBM  A2111 (-4.2A)
IBM  A2111 (-3.6A)
 0.52A 1xoqB-1sojA:
42.2		 1xoqB-1sojA:
31.99
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1XOS_A_VIAA1_1
(CAMP-SPECIFIC
3',5'-CYCLIC
PHOSPHODIESTERASE 4B)		 1soj CGMP-INHIBITED
3',5'-CYCLIC
PHOSPHODIESTERASE B
(Homo
sapiens) 		7 / 12 TYR A 736
HIS A 737
ASP A 937
PHE A 959
GLN A 988
PHE A 991
ILE A 995
 IBM  A2111 (-4.5A)
IBM  A2111 ( 4.8A)
MG  A2123 (-2.5A)
None
IBM  A2111 (-3.3A)
IBM  A2111 (-3.6A)
None
 0.52A 1xosA-1sojA:
41.8		 1xosA-1sojA:
30.21
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1XOS_A_VIAA1_1
(CAMP-SPECIFIC
3',5'-CYCLIC
PHOSPHODIESTERASE 4B)		 1soj CGMP-INHIBITED
3',5'-CYCLIC
PHOSPHODIESTERASE B
(Homo
sapiens) 		6 / 12 TYR A 736
HIS A 737
ASP A 937
PHE A 959
SER A 974
GLN A 988
 IBM  A2111 (-4.5A)
IBM  A2111 ( 4.8A)
MG  A2123 (-2.5A)
None
None
IBM  A2111 (-3.3A)
 1.00A 1xosA-1sojA:
41.8		 1xosA-1sojA:
30.21
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1XOS_A_VIAA1_1
(CAMP-SPECIFIC
3',5'-CYCLIC
PHOSPHODIESTERASE 4B)		 1soj CGMP-INHIBITED
3',5'-CYCLIC
PHOSPHODIESTERASE B
(Homo
sapiens) 		5 / 12 TYR A 736
HIS A 741
GLN A 988
PHE A 991
ILE A 995
 IBM  A2111 (-4.5A)
MG  A2123 (-3.0A)
IBM  A2111 (-3.3A)
IBM  A2111 (-3.6A)
None
 1.48A 1xosA-1sojA:
41.8		 1xosA-1sojA:
30.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1Y93_A_HAEA301_1
(MACROPHAGE
METALLOELASTASE)		 3lmc PEPTIDASE,
ZINC-DEPENDENT
(Methanocorpuscul
um
labreanum) 		4 / 6 HIS A 149
GLU A 150
HIS A 153
HIS A 159
 ZN  A 212 (-3.4A)
ZN  A 212 ( 4.3A)
ZN  A 212 (-3.4A)
ZN  A 212 (-3.3A)
 0.25A 1y93A-3lmcA:
8.2		 1y93A-3lmcA:
24.20
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.
1YDB_A_AZMA264_1
(CARBONIC ANHYDRASE
II)		 3uss PUTATIVE
UNCHARACTERIZED
PROTEIN
(Pseudomonas
aeruginosa) 		5 / 11 HIS A  89
HIS A  91
HIS A 142
VAL A 144
PHE A  78
 FE2  A 212 ( 3.2A)
FE2  A 212 ( 3.2A)
FE2  A 212 (-3.3A)
None
SO4  A 215 (-4.0A)
 1.09A 1ydbA-3ussA:
undetectable		 1ydbA-3ussA:
21.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2A69_C_RPTC8001_1
(DNA-DIRECTED RNA
POLYMERASE BETA
CHAIN
RNA POLYMERASE SIGMA
FACTOR RPOD)		 3uss PUTATIVE
UNCHARACTERIZED
PROTEIN
(Pseudomonas
aeruginosa) 		5 / 11 GLN A 107
PHE A 171
HIS A  89
SER A 145
ILE A  85
 None
None
FE2  A 212 ( 3.2A)
None
None
 1.49A 2a69C-3ussA:
0.0
2a69F-3ussA:
0.0		 2a69C-3ussA:
11.51
2a69F-3ussA:
19.76
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.
2AA6_A_STRA401_1
(MINERALOCORTICOID
RECEPTOR)		 4oud TYROSYL-TRNA
SYNTHETASE
(Escherichia
coli) 		5 / 12 LEU B 194
LEU B  36
ALA B  35
LEU B  29
THR B 212
 LEU  B 194 ( 0.6A)
LEU  B  36 ( 0.6A)
ALA  B  35 ( 0.0A)
LEU  B  29 ( 0.6A)
THR  B 212 ( 0.8A)
 1.23A 2aa6A-4oudB:
undetectable		 2aa6A-4oudB:
22.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2AYL_B_FLPB2701_1
(PROSTAGLANDIN G/H
SYNTHASE 1)		 6fai ESSENTIAL NUCLEAR
PROTEIN 1
(Saccharomyces
cerevisiae) 		5 / 12 VAL i 307
LEU i 283
ILE i 337
GLY i 339
ALA i 338
 None
None
U  21269 ( 3.8A)
None
None
 1.08A 2aylB-6faii:
undetectable		 2aylB-6faii:
8.32
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.
2C8A_B_NCAB1246_0
(MONO-ADP-RIBOSYLTRAN
SFERASE C3)		 3hjg PUTATIVE
ALPHA-RIBAZOLE-5'-PH
OSPHATE PHOSPHATASE
COBC
(Vibrio
parahaemolyticus) 		4 / 7 ARG A  10
GLY A 148
SER A 178
ARG A 152
 SO4  A 212 (-3.4A)
SO4  A 212 (-4.2A)
None
None
 1.09A 2c8aB-3hjgA:
undetectable		 2c8aB-3hjgA:
22.69
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.
2CC8_A_RBFA1067_1
(VNG1446H)		 5ec3 4-HYDROXYPHENYLPYRUV
ATE DIOXYGENASE
(Homo
sapiens) 		3 / 3 PHE A 364
VAL A 212
TRP A 210
 PHE  A 364 ( 1.3A)
VAL  A 212 ( 0.6A)
TRP  A 210 ( 0.5A)
 0.86A 2cc8A-5ec3A:
undetectable		 2cc8A-5ec3A:
11.45
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.
2CCB_A_RBFA1067_1
(VNG1446H)		 5ec3 4-HYDROXYPHENYLPYRUV
ATE DIOXYGENASE
(Homo
sapiens) 		3 / 3 PHE A 364
VAL A 212
TRP A 210
 PHE  A 364 ( 1.3A)
VAL  A 212 ( 0.6A)
TRP  A 210 ( 0.5A)
 0.85A 2ccbA-5ec3A:
undetectable		 2ccbA-5ec3A:
11.45
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.
2EGV_A_SAMA1300_0
(UPF0088 PROTEIN
AQ_165)		 3ab7 PUTATIVE
UNCHARACTERIZED
PROTEIN TTHA0350
(Thermus
thermophilus) 		5 / 12 LEU A 208
VAL A 213
GLY A 212
LEU A 171
ALA A 175
 LEU  A 208 ( 0.6A)
VAL  A 213 ( 0.6A)
GLY  A 212 ( 0.0A)
LEU  A 171 ( 0.6A)
ALA  A 175 ( 0.0A)
 0.88A 2egvA-3ab7A:
3.0		 2egvA-3ab7A:
21.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2EGV_B_SAMB1400_0
(UPF0088 PROTEIN
AQ_165)		 3ab7 PUTATIVE
UNCHARACTERIZED
PROTEIN TTHA0350
(Thermus
thermophilus) 		5 / 12 LEU A 208
VAL A 213
GLY A 212
LEU A 171
ALA A 175
 LEU  A 208 ( 0.6A)
VAL  A 213 ( 0.6A)
GLY  A 212 ( 0.0A)
LEU  A 171 ( 0.6A)
ALA  A 175 ( 0.0A)
 0.91A 2egvB-3ab7A:
2.5		 2egvB-3ab7A:
21.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2EIM_A_CHDA525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1wb8 SUPEROXIDE DISMUTASE
[FE]
(Sulfolobus
solfataricus) 		4 / 6 HIS A  33
ASP A  19
TYR A  16
HIS A  37
 FE  A 212 (-3.3A)
None
None
PMS  A 213 (-4.0A)
 1.50A 2eimA-1wb8A:
undetectable
2eimC-1wb8A:
undetectable		 2eimA-1wb8A:
16.73
2eimC-1wb8A:
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.
2EIN_N_CUN517_0
(CYTOCHROME C OXIDASE
SUBUNIT 1)		 3lmc PEPTIDASE,
ZINC-DEPENDENT
(Methanocorpuscul
um
labreanum) 		3 / 3 HIS A 159
HIS A 153
HIS A 149
 ZN  A 212 (-3.3A)
ZN  A 212 (-3.4A)
ZN  A 212 (-3.4A)
 0.73A 2einN-3lmcA:
undetectable		 2einN-3lmcA:
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.
2HJH_B_NCAB901_0
(NAD-DEPENDENT
HISTONE DEACETYLASE
SIR2)		 3r64 NAD DEPENDENT
BENZALDEHYDE
DEHYDROGENASE
(Corynebacterium
glutamicum) 		4 / 5 ILE A 181
PRO A 183
PHE A 223
VAL A 212
 ILE  A 181 ( 0.7A)
PRO  A 183 ( 1.1A)
PHE  A 223 ( 1.3A)
VAL  A 212 ( 0.6A)
 1.39A 2hjhB-3r64A:
undetectable		 2hjhB-3r64A:
20.35
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.
2HU6_A_HAEA269_1
(MACROPHAGE
METALLOELASTASE)		 3lmc PEPTIDASE,
ZINC-DEPENDENT
(Methanocorpuscul
um
labreanum) 		4 / 4 HIS A 149
GLU A 150
HIS A 153
HIS A 159
 ZN  A 212 (-3.4A)
ZN  A 212 ( 4.3A)
ZN  A 212 (-3.4A)
ZN  A 212 (-3.3A)
 0.21A 2hu6A-3lmcA:
8.2		 2hu6A-3lmcA:
24.20
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.
2IWK_A_CUA1599_0
(NITROUS OXIDE
REDUCTASE)		 3esr D,D-HEPTOSE
1,7-BISPHOSPHATE
PHOSPHATASE
(Escherichia
coli) 		3 / 3 CYH A 112
CYH A 127
HIS A 114
 ZN  A 212 (-2.2A)
ZN  A 212 (-2.4A)
ZN  A 212 (-3.4A)
 0.86A 2iwkA-3esrA:
undetectable		 2iwkA-3esrA:
16.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2IWK_B_CUB1599_0
(NITROUS OXIDE
REDUCTASE)		 3esr D,D-HEPTOSE
1,7-BISPHOSPHATE
PHOSPHATASE
(Escherichia
coli) 		3 / 3 CYH A 112
CYH A 127
HIS A 114
 ZN  A 212 (-2.2A)
ZN  A 212 (-2.4A)
ZN  A 212 (-3.4A)
 0.86A 2iwkB-3esrA:
undetectable		 2iwkB-3esrA:
16.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2JIH_A_097A1001_1
(ADAMTS-1)		 3lmc PEPTIDASE,
ZINC-DEPENDENT
(Methanocorpuscul
um
labreanum) 		5 / 9 HIS A 149
GLU A 150
HIS A 153
HIS A 159
LEU A 176
 ZN  A 212 (-3.4A)
ZN  A 212 ( 4.3A)
ZN  A 212 (-3.4A)
ZN  A 212 (-3.3A)
None
 0.70A 2jihA-3lmcA:
12.5		 2jihA-3lmcA:
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.
2JIH_B_097B1001_1
(ADAMTS-1)		 3lmc PEPTIDASE,
ZINC-DEPENDENT
(Methanocorpuscul
um
labreanum) 		4 / 8 HIS A 149
GLU A 150
HIS A 153
HIS A 159
 ZN  A 212 (-3.4A)
ZN  A 212 ( 4.3A)
ZN  A 212 (-3.4A)
ZN  A 212 (-3.3A)
 0.19A 2jihB-3lmcA:
12.7		 2jihB-3lmcA:
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.
2NYU_B_SAMB201_1
(PUTATIVE RIBOSOMAL
RNA
METHYLTRANSFERASE 2)		 1w2w 5-METHYLTHIORIBOSE-1
-PHOSPHATE ISOMERASE
5-METHYLTHIORIBOSE-1
-PHOSPHATE ISOMERASE
(Saccharomyces
cerevisiae;
Saccharomyces
cerevisiae) 		4 / 5 PRO A  54
ALA A  55
ASP B 280
ASP B 380
 None
None
SO4  A1212 (-3.8A)
None
 1.20A 2nyuB-1w2wA:
undetectable		 2nyuB-1w2wA:
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.
2OW9_A_HAEA502_1
(COLLAGENASE 3)		 3lmc PEPTIDASE,
ZINC-DEPENDENT
(Methanocorpuscul
um
labreanum) 		4 / 6 HIS A 149
GLU A 150
HIS A 153
HIS A 159
 ZN  A 212 (-3.4A)
ZN  A 212 ( 4.3A)
ZN  A 212 (-3.4A)
ZN  A 212 (-3.3A)
 0.26A 2ow9A-3lmcA:
7.3		 2ow9A-3lmcA:
22.27
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.
2OW9_B_HAEB502_1
(COLLAGENASE 3)		 3lmc PEPTIDASE,
ZINC-DEPENDENT
(Methanocorpuscul
um
labreanum) 		4 / 4 HIS A 149
GLU A 150
HIS A 153
HIS A 159
 ZN  A 212 (-3.4A)
ZN  A 212 ( 4.3A)
ZN  A 212 (-3.4A)
ZN  A 212 (-3.3A)
 0.28A 2ow9B-3lmcA:
6.9		 2ow9B-3lmcA:
22.27
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.
2OZR_C_HAEC3001_1
(COLLAGENASE 3)		 3lmc PEPTIDASE,
ZINC-DEPENDENT
(Methanocorpuscul
um
labreanum) 		4 / 4 HIS A 149
GLU A 150
HIS A 153
HIS A 159
 ZN  A 212 (-3.4A)
ZN  A 212 ( 4.3A)
ZN  A 212 (-3.4A)
ZN  A 212 (-3.3A)
 0.30A 2ozrC-3lmcA:
5.5		 2ozrC-3lmcA:
22.27
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.
2OZR_D_HAED3002_1
(COLLAGENASE 3)		 3lmc PEPTIDASE,
ZINC-DEPENDENT
(Methanocorpuscul
um
labreanum) 		4 / 4 HIS A 149
GLU A 150
HIS A 153
HIS A 159
 ZN  A 212 (-3.4A)
ZN  A 212 ( 4.3A)
ZN  A 212 (-3.4A)
ZN  A 212 (-3.3A)
 0.28A 2ozrD-3lmcA:
5.4		 2ozrD-3lmcA:
22.27
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.
2OZR_E_HAEE3003_1
(COLLAGENASE 3)		 3lmc PEPTIDASE,
ZINC-DEPENDENT
(Methanocorpuscul
um
labreanum) 		4 / 4 HIS A 149
GLU A 150
HIS A 153
HIS A 159
 ZN  A 212 (-3.4A)
ZN  A 212 ( 4.3A)
ZN  A 212 (-3.4A)
ZN  A 212 (-3.3A)
 0.30A 2ozrE-3lmcA:
5.8		 2ozrE-3lmcA:
22.27
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.
2OZR_F_HAEF3004_1
(COLLAGENASE 3)		 3lmc PEPTIDASE,
ZINC-DEPENDENT
(Methanocorpuscul
um
labreanum) 		3 / 3 HIS A 149
HIS A 153
HIS A 159
 ZN  A 212 (-3.4A)
ZN  A 212 (-3.4A)
ZN  A 212 (-3.3A)
 0.25A 2ozrF-3lmcA:
7.0		 2ozrF-3lmcA:
22.27
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.
2Q0J_A_BEZA500_0
(QUINOLONE SIGNAL
RESPONSE PROTEIN)		 2xf4 HYDROXYACYLGLUTATHIO
NE HYDROLASE
(Salmonella
enterica) 		5 / 10 ASP A  60
HIS A 132
ASP A 151
PHE A 163
HIS A 192
 ZN  A1211 ( 2.8A)
None
ZN  A1211 (-2.4A)
PG4  A1212 (-4.6A)
ZN  A1211 (-3.3A)
 0.83A 2q0jA-2xf4A:
18.4		 2q0jA-2xf4A:
24.62
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.
2Q0J_B_BEZB500_0
(QUINOLONE SIGNAL
RESPONSE PROTEIN)		 2xf4 HYDROXYACYLGLUTATHIO
NE HYDROLASE
(Salmonella
enterica) 		6 / 11 ASP A  60
HIS A  61
HIS A 132
ASP A 151
PHE A 163
HIS A 192
 ZN  A1211 ( 2.8A)
ZN  A1211 (-3.3A)
None
ZN  A1211 (-2.4A)
PG4  A1212 (-4.6A)
ZN  A1211 (-3.3A)
 0.87A 2q0jB-2xf4A:
18.5		 2q0jB-2xf4A:
24.62
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.
2Q6K_A_ADNA699_1
(CHLORINASE)		 2go7 HYDROLASE, HALOACID
DEHALOGENASE-LIKE
FAMILY
(Streptococcus
pneumoniae) 		4 / 7 PHE A 126
TYR A 161
TYR A 106
THR A 107
 None
None
CL  A 210 ( 4.3A)
CL  A 212 (-4.1A)
 1.44A 2q6kA-2go7A:
2.1		 2q6kA-2go7A:
21.74
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.
2R5Q_B_1UNB900_1
(PROTEASE)		 1fxj UDP-N-ACETYLGLUCOSAM
INE
PYROPHOSPHORYLASE
(Escherichia
coli) 		5 / 9 LEU A 184
ILE A 212
GLY A 127
ILE A 174
ILE A 201
 LEU  A 184 ( 0.6A)
ILE  A 212 ( 0.7A)
GLY  A 127 ( 0.0A)
ILE  A 174 ( 0.7A)
ILE  A 201 ( 0.6A)
 1.16A 2r5qA-1fxjA:
undetectable		 2r5qA-1fxjA:
16.11
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.
2R5Q_D_1UND900_1
(PROTEASE)		 1fxj UDP-N-ACETYLGLUCOSAM
INE
PYROPHOSPHORYLASE
(Escherichia
coli) 		5 / 9 LEU A 184
ILE A 212
GLY A 127
ILE A 174
ILE A 201
 LEU  A 184 ( 0.6A)
ILE  A 212 ( 0.7A)
GLY  A 127 ( 0.0A)
ILE  A 174 ( 0.7A)
ILE  A 201 ( 0.6A)
 1.16A 2r5qC-1fxjA:
undetectable		 2r5qC-1fxjA:
16.11
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.
2UYQ_A_SAMA1311_0
(HYPOTHETICAL PROTEIN
ML2640)		 2hp3 IDS-EPIMERASE
(Agrobacterium
tumefaciens) 		4 / 7 GLY A 373
VAL A 306
ASP A 379
ARG A 392
 UNX  A1212 ( 3.6A)
None
None
EDO  A1005 (-4.2A)
 0.67A 2uyqA-2hp3A:
undetectable		 2uyqA-2hp3A:
25.65
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.
2V3K_A_SAMA1254_0
(ESSENTIAL FOR
MITOTIC GROWTH 1)		 3ab7 PUTATIVE
UNCHARACTERIZED
PROTEIN TTHA0350
(Thermus
thermophilus) 		5 / 10 LEU A 208
VAL A 213
GLY A 212
LEU A 171
ALA A 175
 LEU  A 208 ( 0.6A)
VAL  A 213 ( 0.6A)
GLY  A 212 ( 0.0A)
LEU  A 171 ( 0.6A)
ALA  A 175 ( 0.0A)
 0.98A 2v3kA-3ab7A:
undetectable		 2v3kA-3ab7A:
21.69
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.
2VX9_A_RBFA1064_1
(DODECIN)		 5ec3 4-HYDROXYPHENYLPYRUV
ATE DIOXYGENASE
(Homo
sapiens) 		3 / 3 PHE A 364
VAL A 212
TRP A 210
 PHE  A 364 ( 1.3A)
VAL  A 212 ( 0.6A)
TRP  A 210 ( 0.5A)
 0.84A 2vx9A-5ec3A:
undetectable		 2vx9A-5ec3A:
12.04
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.
2WLK_B_SPMB1302_1
(ATP-SENSITIVE INWARD
RECTIFIER POTASSIUM
CHANNEL 10)		 3qz5 CO-TYPE NITRILE
HYDRATASE ALPHA
SUBUNIT
(Pseudomonas
putida) 		4 / 4 ALA A 132
TYR A 135
ALA A 128
TYR A 130
 GOL  A 212 ( 3.8A)
None
None
None
 0.95A 2wlkA-3qz5A:
undetectable
2wlkB-3qz5A:
undetectable		 2wlkA-3qz5A:
23.29
2wlkB-3qz5A:
23.29
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.
2X9G_A_LYAA1270_2
(PTERIDINE REDUCTASE)		 2bv7 GLYCOLIPID TRANSFER
PROTEIN
(Bos
taurus) 		3 / 3 MET A 134
VAL A 209
GLU A 204
 None
GM3  A1212 (-4.6A)
SO4  A1210 ( 4.8A)
 0.82A 2x9gA-2bv7A:
undetectable		 2x9gA-2bv7A:
20.07
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.
2XAD_E_GCSE710_1
(N-ACYL GLM
PEUDO-TEICOPLANIN
DEACETYLASE
TEICOPLANIN)		 1soj CGMP-INHIBITED
3',5'-CYCLIC
PHOSPHODIESTERASE B
(Homo
sapiens) 		4 / 8 HIS A 821
ASP A 937
ILE A 938
HIS A 741
 MG  A2123 (-3.1A)
MG  A2123 (-2.5A)
IBM  A2111 (-4.1A)
MG  A2123 (-3.0A)
 1.05A 2xadA-1sojA:
undetectable		 2xadA-1sojA:
22.39
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.
2XAD_F_GCSF710_1
(N-ACYL GLM
PEUDO-TEICOPLANIN
DEACETYLASE
TEICOPLANIN)		 1soj CGMP-INHIBITED
3',5'-CYCLIC
PHOSPHODIESTERASE B
(Homo
sapiens) 		4 / 8 HIS A 821
ASP A 937
ILE A 938
HIS A 741
 MG  A2123 (-3.1A)
MG  A2123 (-2.5A)
IBM  A2111 (-4.1A)
MG  A2123 (-3.0A)
 1.09A 2xadB-1sojA:
undetectable		 2xadB-1sojA:
22.39
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.
2XAD_G_GCSG710_1
(N-ACYL GLM
PEUDO-TEICOPLANIN
DEACETYLASE
TEICOPLANIN)		 1soj CGMP-INHIBITED
3',5'-CYCLIC
PHOSPHODIESTERASE B
(Homo
sapiens) 		4 / 8 HIS A 821
ASP A 937
ILE A 938
HIS A 741
 MG  A2123 (-3.1A)
MG  A2123 (-2.5A)
IBM  A2111 (-4.1A)
MG  A2123 (-3.0A)
 1.07A 2xadC-1sojA:
undetectable		 2xadC-1sojA:
22.39
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.
2XAD_H_GCSH710_1
(N-ACYL GLM
PEUDO-TEICOPLANIN
DEACETYLASE
TEICOPLANIN)		 1soj CGMP-INHIBITED
3',5'-CYCLIC
PHOSPHODIESTERASE B
(Homo
sapiens) 		4 / 8 HIS A 821
ASP A 937
ILE A 938
HIS A 741
 MG  A2123 (-3.1A)
MG  A2123 (-2.5A)
IBM  A2111 (-4.1A)
MG  A2123 (-3.0A)
 1.07A 2xadD-1sojA:
undetectable		 2xadD-1sojA:
22.39
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.
2ZI9_A_CL9A401_2
(DEOXYCYTIDINE KINASE)		 4flx DNA POLYMERASE 1
(Pyrococcus
abyssi) 		3 / 3 ASP A 212
PHE A 216
LEU A 220
 ASP  A 212 ( 0.6A)
PHE  A 216 ( 1.3A)
LEU  A 220 ( 0.6A)
 0.69A 2zi9A-4flxA:
undetectable		 2zi9A-4flxA:
18.30
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.
2ZWE_B_DAHB98_1
(TYROSINASE
MELC)		 3uss PUTATIVE
UNCHARACTERIZED
PROTEIN
(Pseudomonas
aeruginosa) 		5 / 11 HIS A 142
HIS A  91
HIS A 157
VAL A 131
SER A 106
 FE2  A 212 (-3.3A)
FE2  A 212 ( 3.2A)
SO4  A 215 (-4.1A)
None
None
 1.18A 2zweA-3ussA:
undetectable
2zweB-3ussA:
undetectable		 2zweA-3ussA:
23.13
2zweB-3ussA:
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.
2ZWF_B_DAHB98_1
(TYROSINASE
MELC)		 3uss PUTATIVE
UNCHARACTERIZED
PROTEIN
(Pseudomonas
aeruginosa) 		5 / 11 HIS A 142
HIS A  91
HIS A 157
VAL A 131
SER A 106
 FE2  A 212 (-3.3A)
FE2  A 212 ( 3.2A)
SO4  A 215 (-4.1A)
None
None
 1.14A 2zwfA-3ussA:
undetectable
2zwfB-3ussA:
undetectable		 2zwfA-3ussA:
23.13
2zwfB-3ussA:
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.
2ZWG_B_DAHB98_1
(TYROSINASE
MELC)		 3uss PUTATIVE
UNCHARACTERIZED
PROTEIN
(Pseudomonas
aeruginosa) 		5 / 11 HIS A 142
HIS A  91
HIS A 157
VAL A 131
SER A 106
 FE2  A 212 (-3.3A)
FE2  A 212 ( 3.2A)
SO4  A 215 (-4.1A)
None
None
 1.12A 2zwgA-3ussA:
undetectable
2zwgB-3ussA:
undetectable		 2zwgA-3ussA:
23.13
2zwgB-3ussA:
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.
3A50_D_VD3D2001_1
(VITAMIN D
HYDROXYLASE)		 1gnw GLUTATHIONE
S-TRANSFERASE
(Arabidopsis
thaliana) 		5 / 12 PRO A  55
LEU A  21
ILE A  74
ALA A  75
LEU A 170
 GTX  A 212 (-4.6A)
None
None
None
None
 1.10A 3a50D-1gnwA:
2.6		 3a50D-1gnwA:
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.
3CJT_K_SAMK302_0
(RIBOSOMAL PROTEIN
L11
METHYLTRANSFERASE)		 1u60 PROBABLE GLUTAMINASE
YBAS
(Escherichia
coli) 		5 / 12 GLY A 264
ILE A 266
SER A 260
ASN A  26
LEU A 283
 None
None
None
None
FMT  A1212 ( 4.5A)
 0.91A 3cjtK-1u60A:
undetectable		 3cjtK-1u60A:
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.
3CZV_A_AZMA263_1
(CARBONIC ANHYDRASE
13)		 1soj CGMP-INHIBITED
3',5'-CYCLIC
PHOSPHODIESTERASE B
(Homo
sapiens) 		5 / 12 HIS A 741
HIS A 821
PHE A 991
THR A 893
VAL A 996
 MG  A2123 (-3.0A)
MG  A2123 (-3.1A)
IBM  A2111 (-3.6A)
None
None
 1.23A 3czvA-1sojA:
undetectable
3czvB-1sojA:
undetectable		 3czvA-1sojA:
21.65
3czvB-1sojA:
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.
3DTU_B_CUB1022_0
(CYTOCHROME C OXIDASE
SUBUNIT 2)		 3esr D,D-HEPTOSE
1,7-BISPHOSPHATE
PHOSPHATASE
(Escherichia
coli) 		3 / 3 CYH A 112
CYH A 127
HIS A 114
 ZN  A 212 (-2.2A)
ZN  A 212 (-2.4A)
ZN  A 212 (-3.4A)
 0.72A 3dtuB-3esrA:
undetectable		 3dtuB-3esrA:
21.59
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.
3DTU_D_CUD3_0
(CYTOCHROME C OXIDASE
SUBUNIT 2)		 3esr D,D-HEPTOSE
1,7-BISPHOSPHATE
PHOSPHATASE
(Escherichia
coli) 		3 / 3 CYH A 112
CYH A 127
HIS A 114
 ZN  A 212 (-2.2A)
ZN  A 212 (-2.4A)
ZN  A 212 (-3.4A)
 0.70A 3dtuD-3esrA:
undetectable		 3dtuD-3esrA:
21.59
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.
3FL9_G_TOPG200_1
(DIHYDROFOLATE
REDUCTASE (DHFR))		 3gle PILIN
(Streptococcus
pyogenes) 		6 / 12 LEU A 198
LEU A 175
VAL A 177
ILE A 212
PHE A 235
THR A 287
 LEU  A 198 ( 0.6A)
LEU  A 175 ( 0.5A)
VAL  A 177 ( 0.6A)
ILE  A 212 ( 0.7A)
PHE  A 235 ( 1.3A)
THR  A 287 ( 0.8A)
 1.42A 3fl9G-3gleA:
undetectable		 3fl9G-3gleA:
17.63
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.
3FL9_H_TOPH200_1
(DIHYDROFOLATE
REDUCTASE (DHFR))		 3gle PILIN
(Streptococcus
pyogenes) 		5 / 9 LEU A 175
VAL A 177
ILE A 212
PHE A 235
THR A 287
 LEU  A 175 ( 0.5A)
VAL  A 177 ( 0.6A)
ILE  A 212 ( 0.7A)
PHE  A 235 ( 1.3A)
THR  A 287 ( 0.8A)
 1.28A 3fl9H-3gleA:
undetectable		 3fl9H-3gleA:
17.63
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3G4L_B_ROFB902_0
(CAMP-SPECIFIC
3',5'-CYCLIC
PHOSPHODIESTERASE 4D)		 1soj CGMP-INHIBITED
3',5'-CYCLIC
PHOSPHODIESTERASE B
(Homo
sapiens) 		8 / 12 TYR A 736
HIS A 737
ASP A 937
PRO A 941
TRP A 951
THR A 952
ILE A 955
PHE A 991
 IBM  A2111 (-4.5A)
IBM  A2111 ( 4.8A)
MG  A2123 (-2.5A)
None
None
IBM  A2111 ( 4.8A)
IBM  A2111 (-4.2A)
IBM  A2111 (-3.6A)
 0.48A 3g4lB-1sojA:
41.7		 3g4lB-1sojA:
32.26
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3G4L_C_ROFC903_0
(CAMP-SPECIFIC
3',5'-CYCLIC
PHOSPHODIESTERASE 4D)		 1soj CGMP-INHIBITED
3',5'-CYCLIC
PHOSPHODIESTERASE B
(Homo
sapiens) 		7 / 12 TYR A 736
HIS A 737
ASP A 937
PRO A 941
TRP A 951
THR A 952
ILE A 955
 IBM  A2111 (-4.5A)
IBM  A2111 ( 4.8A)
MG  A2123 (-2.5A)
None
None
IBM  A2111 ( 4.8A)
IBM  A2111 (-4.2A)
 0.49A 3g4lC-1sojA:
41.6		 3g4lC-1sojA:
32.26
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3G4L_D_ROFD904_0
(CAMP-SPECIFIC
3',5'-CYCLIC
PHOSPHODIESTERASE 4D)		 1soj CGMP-INHIBITED
3',5'-CYCLIC
PHOSPHODIESTERASE B
(Homo
sapiens) 		8 / 12 TYR A 736
HIS A 737
ASP A 937
PRO A 941
TRP A 951
THR A 952
ILE A 955
GLN A 988
 IBM  A2111 (-4.5A)
IBM  A2111 ( 4.8A)
MG  A2123 (-2.5A)
None
None
IBM  A2111 ( 4.8A)
IBM  A2111 (-4.2A)
IBM  A2111 (-3.3A)
 0.51A 3g4lD-1sojA:
41.3		 3g4lD-1sojA:
32.26
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.
3GLQ_A_RABA602_2
(ADENOSYLHOMOCYSTEINA
SE)		 1soj CGMP-INHIBITED
3',5'-CYCLIC
PHOSPHODIESTERASE B
(Homo
sapiens) 		4 / 5 GLN A 840
GLU A 851
THR A 893
HIS A 821
 None
None
None
MG  A2123 (-3.1A)
 1.16A 3glqA-1sojA:
undetectable		 3glqA-1sojA:
20.27
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.
3GLQ_B_RABB602_2
(ADENOSYLHOMOCYSTEINA
SE)		 1soj CGMP-INHIBITED
3',5'-CYCLIC
PHOSPHODIESTERASE B
(Homo
sapiens) 		4 / 5 GLN A 840
GLU A 851
THR A 893
HIS A 821
 None
None
None
MG  A2123 (-3.1A)
 1.06A 3glqB-1sojA:
undetectable		 3glqB-1sojA:
20.27
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.
3H52_C_486C4_2
(GLUCOCORTICOID
RECEPTOR)		 1w2w 5-METHYLTHIORIBOSE-1
-PHOSPHATE ISOMERASE
(Saccharomyces
cerevisiae) 		3 / 3 MET A  48
CYH A 181
PRO B 234
 SO4  A1212 (-4.7A)
SO4  A1212 ( 4.0A)
None
 1.14A 3h52C-1w2wA:
undetectable		 3h52C-1w2wA:
21.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3HY7_B_097B801_1
(A DISINTEGRIN AND
METALLOPROTEINASE
WITH THROMBOSPONDIN
MOTIFS 5)		 3lmc PEPTIDASE,
ZINC-DEPENDENT
(Methanocorpuscul
um
labreanum) 		5 / 9 HIS A 149
GLU A 150
HIS A 153
HIS A 159
LEU A 176
 ZN  A 212 (-3.4A)
ZN  A 212 ( 4.3A)
ZN  A 212 (-3.4A)
ZN  A 212 (-3.3A)
None
 0.72A 3hy7B-3lmcA:
13.2		 3hy7B-3lmcA:
23.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3JAY_A_SAMA1101_0
(STRUCTURAL PROTEIN
VP3)		 4ce4 MRPL4
MRPL15
MRPL49
(Sus
scrofa;
Sus
scrofa;
Sus
scrofa) 		5 / 12 SER P  33
GLU l 142
VAL F 176
ASP F  94
ILE F  95
 U  A 212 ( 2.7A)
A  A 213 ( 4.4A)
None
U  A 212 ( 3.7A)
None
 1.32A 3jayA-4ce4P:
undetectable		 3jayA-4ce4P:
12.92
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.
3KEC_A_HAEA272_1
(COLLAGENASE 3)		 3lmc PEPTIDASE,
ZINC-DEPENDENT
(Methanocorpuscul
um
labreanum) 		4 / 5 HIS A 149
GLU A 150
HIS A 153
HIS A 159
 ZN  A 212 (-3.4A)
ZN  A 212 ( 4.3A)
ZN  A 212 (-3.4A)
ZN  A 212 (-3.3A)
 0.24A 3kecA-3lmcA:
7.2		 3kecA-3lmcA:
22.73
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.
3KK6_A_CELA701_1
(PROSTAGLANDIN G/H
SYNTHASE 1)		 6fai ESSENTIAL NUCLEAR
PROTEIN 1
(Saccharomyces
cerevisiae) 		5 / 12 VAL i 307
LEU i 283
ILE i 337
GLY i 339
ALA i 338
 None
None
U  21269 ( 3.8A)
None
None
 1.07A 3kk6A-6faii:
undetectable		 3kk6A-6faii:
8.32
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.
3KKZ_A_SAMA301_0
(UNCHARACTERIZED
PROTEIN Q5LES9)		 4mes THIAMINE TRANSPORTER
THIT
(Lactococcus
lactis) 		5 / 12 GLY A  59
GLY A  56
LEU A  61
LEU A  92
ALA A  18
 None
None
PEG  A 212 ( 3.7A)
None
None
 1.16A 3kkzA-4mesA:
undetectable		 3kkzA-4mesA:
20.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3LIK_A_HAEA302_1
(MACROPHAGE
METALLOELASTASE)		 3lmc PEPTIDASE,
ZINC-DEPENDENT
(Methanocorpuscul
um
labreanum) 		4 / 5 HIS A 149
GLU A 150
HIS A 153
HIS A 159
 ZN  A 212 (-3.4A)
ZN  A 212 ( 4.3A)
ZN  A 212 (-3.4A)
ZN  A 212 (-3.3A)
 0.25A 3likA-3lmcA:
8.2		 3likA-3lmcA:
24.20
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.
3LIL_A_HAEA302_1
(MACROPHAGE
METALLOELASTASE)		 3lmc PEPTIDASE,
ZINC-DEPENDENT
(Methanocorpuscul
um
labreanum) 		4 / 4 HIS A 149
GLU A 150
HIS A 153
HIS A 159
 ZN  A 212 (-3.4A)
ZN  A 212 ( 4.3A)
ZN  A 212 (-3.4A)
ZN  A 212 (-3.3A)
 0.26A 3lilA-3lmcA:
8.3		 3lilA-3lmcA:
24.20
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.
3LJG_A_HAEA301_1
(MACROPHAGE
METALLOELASTASE)		 3lmc PEPTIDASE,
ZINC-DEPENDENT
(Methanocorpuscul
um
labreanum) 		4 / 5 HIS A 149
GLU A 150
HIS A 153
HIS A 159
 ZN  A 212 (-3.4A)
ZN  A 212 ( 4.3A)
ZN  A 212 (-3.4A)
ZN  A 212 (-3.3A)
 0.25A 3ljgA-3lmcA:
5.8		 3ljgA-3lmcA:
24.20
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.
3LKA_A_HAEA269_1
(MACROPHAGE
METALLOELASTASE)		 3lmc PEPTIDASE,
ZINC-DEPENDENT
(Methanocorpuscul
um
labreanum) 		4 / 5 HIS A 149
GLU A 150
HIS A 153
HIS A 159
 ZN  A 212 (-3.4A)
ZN  A 212 ( 4.3A)
ZN  A 212 (-3.4A)
ZN  A 212 (-3.3A)
 0.22A 3lkaA-3lmcA:
8.1		 3lkaA-3lmcA:
23.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3M7R_A_VDXA425_1
(VITAMIN D3 RECEPTOR)		 2wdu GLUTATHIONE
TRANSFERASE SIGMA
CLASS
(Fasciola
hepatica) 		5 / 12 TYR A  93
LEU A 135
LEU A 138
VAL A 139
SER A 142
 DMS  A1212 ( 4.7A)
None
None
None
None
 1.31A 3m7rA-2wduA:
undetectable		 3m7rA-2wduA:
22.73
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.
3N58_A_ADNA500_2
(ADENOSYLHOMOCYSTEINA
SE)		 1soj CGMP-INHIBITED
3',5'-CYCLIC
PHOSPHODIESTERASE B
(Homo
sapiens) 		4 / 5 GLN A 840
GLU A 851
THR A 893
HIS A 821
 None
None
None
MG  A2123 (-3.1A)
 1.05A 3n58A-1sojA:
undetectable		 3n58A-1sojA:
20.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3NVC_A_SALA370_1
(GENTISATE
1,2-DIOXYGENASE)		 3uss PUTATIVE
UNCHARACTERIZED
PROTEIN
(Pseudomonas
aeruginosa) 		4 / 6 GLN A  62
HIS A  91
HIS A 142
HIS A  89
 SO4  A 215 ( 4.5A)
FE2  A 212 ( 3.2A)
FE2  A 212 (-3.3A)
FE2  A 212 ( 3.2A)
 1.04A 3nvcA-3ussA:
6.9		 3nvcA-3ussA:
22.73
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3O94_A_NCAA192_0
(NICOTINAMIDASE)		 2wt9 NICOTINAMIDASE
(Acinetobacter
baumannii) 		6 / 11 ASP A  16
PHE A  21
LEU A  27
ASP A  54
HIS A  89
TYR A 123
 NIO  A1216 (-3.8A)
NIO  A1216 (-3.7A)
None
ZN  A1212 ( 2.6A)
ZN  A1212 ( 3.5A)
NIO  A1216 (-4.9A)
 0.42A 3o94A-2wt9A:
22.5		 3o94A-2wt9A:
31.98
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3O94_B_NCAB192_0
(NICOTINAMIDASE)		 2wt9 NICOTINAMIDASE
(Acinetobacter
baumannii) 		6 / 11 ASP A  16
PHE A  21
LEU A  27
ASP A  54
HIS A  89
TYR A 123
 NIO  A1216 (-3.8A)
NIO  A1216 (-3.7A)
None
ZN  A1212 ( 2.6A)
ZN  A1212 ( 3.5A)
NIO  A1216 (-4.9A)
 0.38A 3o94B-2wt9A:
22.4		 3o94B-2wt9A:
31.98
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3O94_C_NCAC192_0
(NICOTINAMIDASE)		 2wt9 NICOTINAMIDASE
(Acinetobacter
baumannii) 		6 / 11 ASP A  16
PHE A  21
LEU A  27
ASP A  54
HIS A  89
TYR A 123
 NIO  A1216 (-3.8A)
NIO  A1216 (-3.7A)
None
ZN  A1212 ( 2.6A)
ZN  A1212 ( 3.5A)
NIO  A1216 (-4.9A)
 0.41A 3o94C-2wt9A:
22.4		 3o94C-2wt9A:
31.98
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3O94_D_NCAD192_0
(NICOTINAMIDASE)		 2wt9 NICOTINAMIDASE
(Acinetobacter
baumannii) 		6 / 11 ASP A  16
PHE A  21
LEU A  27
ASP A  54
HIS A  89
TYR A 123
 NIO  A1216 (-3.8A)
NIO  A1216 (-3.7A)
None
ZN  A1212 ( 2.6A)
ZN  A1212 ( 3.5A)
NIO  A1216 (-4.9A)
 0.42A 3o94D-2wt9A:
22.3		 3o94D-2wt9A:
31.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3PP7_B_SVRB499_1
(PYRUVATE KINASE)		 2hp3 IDS-EPIMERASE
(Agrobacterium
tumefaciens) 		5 / 10 PRO A 397
GLY A 373
TYR A 272
GLY A 280
ALA A 279
 None
UNX  A1212 ( 3.6A)
None
None
None
 1.40A 3pp7B-2hp3A:
undetectable		 3pp7B-2hp3A:
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.
3R0L_D_ACTD127_0
(PHOSPHOLIPASE A2 CB)		 2bv7 GLYCOLIPID TRANSFER
PROTEIN
(Bos
taurus) 		4 / 5 PHE A 148
ILE A  45
GLY A 100
HIS A 140
 GM3  A1212 (-4.6A)
GM3  A1212 (-4.4A)
GM3  A1212 ( 3.7A)
GM3  A1212 (-3.6A)
 1.24A 3r0lD-2bv7A:
undetectable		 3r0lD-2bv7A:
19.50
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3R2J_A_NIOA311_1
(ALPHA/BETA-HYDROLASE
-LIKE PROTEIN)		 2wt9 NICOTINAMIDASE
(Acinetobacter
baumannii) 		8 / 9 ASP A  16
LEU A  27
ASP A  54
TRP A  86
HIS A  89
LYS A 114
ALA A 155
PHE A 158
 NIO  A1216 (-3.8A)
None
ZN  A1212 ( 2.6A)
NIO  A1216 (-3.3A)
ZN  A1212 ( 3.5A)
NIO  A1216 ( 4.5A)
NIO  A1216 (-3.8A)
None
 0.45A 3r2jA-2wt9A:
30.2		 3r2jA-2wt9A:
37.70
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3R2J_B_NIOB311_1
(ALPHA/BETA-HYDROLASE
-LIKE PROTEIN)		 2wt9 NICOTINAMIDASE
(Acinetobacter
baumannii) 		10 / 11 ASP A  16
PHE A  21
LEU A  27
ASP A  54
TRP A  86
HIS A  89
LYS A 114
TYR A 123
ALA A 155
PHE A 158
 NIO  A1216 (-3.8A)
NIO  A1216 (-3.7A)
None
ZN  A1212 ( 2.6A)
NIO  A1216 (-3.3A)
ZN  A1212 ( 3.5A)
NIO  A1216 ( 4.5A)
NIO  A1216 (-4.9A)
NIO  A1216 (-3.8A)
None
 0.55A 3r2jB-2wt9A:
29.5		 3r2jB-2wt9A:
37.70
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3R2J_B_NIOB311_1
(ALPHA/BETA-HYDROLASE
-LIKE PROTEIN)		 2wt9 NICOTINAMIDASE
(Acinetobacter
baumannii) 		5 / 11 ASP A  54
PHE A  21
LEU A  27
TYR A 123
PHE A 158
 ZN  A1212 ( 2.6A)
NIO  A1216 (-3.7A)
None
NIO  A1216 (-4.9A)
None
 1.37A 3r2jB-2wt9A:
29.5		 3r2jB-2wt9A:
37.70
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3R2J_C_NIOC311_1
(ALPHA/BETA-HYDROLASE
-LIKE PROTEIN)		 2wt9 NICOTINAMIDASE
(Acinetobacter
baumannii) 		5 / 12 ASP A  16
ASP A  54
HIS A  89
TYR A 123
PHE A 158
 NIO  A1216 (-3.8A)
ZN  A1212 ( 2.6A)
ZN  A1212 ( 3.5A)
NIO  A1216 (-4.9A)
None
 1.32A 3r2jC-2wt9A:
30.3		 3r2jC-2wt9A:
37.70
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3R2J_C_NIOC311_1
(ALPHA/BETA-HYDROLASE
-LIKE PROTEIN)		 2wt9 NICOTINAMIDASE
(Acinetobacter
baumannii) 		11 / 12 ASP A  16
PHE A  21
LEU A  27
ASP A  54
HIS A  56
TRP A  86
HIS A  89
LYS A 114
TYR A 123
ALA A 155
PHE A 158
 NIO  A1216 (-3.8A)
NIO  A1216 (-3.7A)
None
ZN  A1212 ( 2.6A)
ZN  A1212 (-3.4A)
NIO  A1216 (-3.3A)
ZN  A1212 ( 3.5A)
NIO  A1216 ( 4.5A)
NIO  A1216 (-4.9A)
NIO  A1216 (-3.8A)
None
 0.45A 3r2jC-2wt9A:
30.3		 3r2jC-2wt9A:
37.70
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3R2J_D_NIOD311_1
(ALPHA/BETA-HYDROLASE
-LIKE PROTEIN)		 2wt9 NICOTINAMIDASE
(Acinetobacter
baumannii) 		10 / 11 ASP A  16
PHE A  21
LEU A  27
ASP A  54
TRP A  86
HIS A  89
LYS A 114
TYR A 123
ALA A 155
PHE A 158
 NIO  A1216 (-3.8A)
NIO  A1216 (-3.7A)
None
ZN  A1212 ( 2.6A)
NIO  A1216 (-3.3A)
ZN  A1212 ( 3.5A)
NIO  A1216 ( 4.5A)
NIO  A1216 (-4.9A)
NIO  A1216 (-3.8A)
None
 0.43A 3r2jD-2wt9A:
30.3		 3r2jD-2wt9A:
37.70
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.
3SO9_A_017A100_1
(HIV-1 PROTEASE)		 1w2w 5-METHYLTHIORIBOSE-1
-PHOSPHATE ISOMERASE
(Saccharomyces
cerevisiae) 		5 / 8 ASN B 290
GLY B 278
ALA B 279
GLY A  52
THR A 108
 None
None
None
SO4  A1212 (-3.6A)
None
 1.36A 3so9A-1w2wB:
undetectable		 3so9A-1w2wB:
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.
3TGV_B_BEZB160_0
(HEME-BINDING PROTEIN
HUTZ)		 5gru DIABODY PROTEIN
(Homo
sapiens) 		4 / 4 LEU H 149
GLY H 150
LEU H 212
GLU H 213
 LEU  H 149 ( 0.6A)
GLY  H 150 ( 0.0A)
LEU  H 212 ( 0.6A)
GLU  H 213 ( 0.6A)
 0.95A 3tgvB-5gruH:
undetectable		 3tgvB-5gruH:
22.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3THR_C_C2FC1410_0
(GLYCINE
N-METHYLTRANSFERASE)		 1gnw GLUTATHIONE
S-TRANSFERASE
(Arabidopsis
thaliana) 		3 / 3 ARG A  48
PRO A  55
PHE A  45
 None
GTX  A 212 (-4.6A)
None
 1.00A 3thrC-1gnwA:
undetectable		 3thrC-1gnwA:
20.33
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3TWP_A_SALA404_1
(ANTHRANILATE
PHOSPHORIBOSYLTRANSF
ERASE)		 5xyi 40S RIBOSOMAL
PROTEIN S5-B,
PUTATIVE
(Trichomonas
vaginalis) 		4 / 7 ASN F 157
ALA F 159
ARG F 148
ALA F 151
 U  21283 ( 3.6A)
None
U  21283 ( 4.9A)
U  21283 ( 4.2A)
 1.10A 3twpA-5xyiF:
undetectable		 3twpA-5xyiF:
19.25
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.
3TYE_B_YTZB902_1
(DIHYDROPTEROATE
SYNTHASE)		 5xxu RIBOSOMAL PROTEIN
US10
RIBOSOMAL PROTEIN
US9
(Toxoplasma
gondii) 		3 / 3 PHE Q 134
LYS U 181
SER U 182
 None
C  21416 ( 3.5A)
C  21275 ( 4.4A)
 1.34A 3tyeB-5xxuQ:
undetectable		 3tyeB-5xxuQ:
16.83
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.
3VLN_A_ASCA904_0
(GLUTATHIONE
S-TRANSFERASE
OMEGA-1)		 1gnw GLUTATHIONE
S-TRANSFERASE
(Arabidopsis
thaliana) 		4 / 6 ARG A  16
PRO A  55
GLU A  66
SER A  67
 GTX  A 212 ( 4.8A)
GTX  A 212 (-4.6A)
GTX  A 212 (-2.3A)
GTX  A 212 (-2.7A)
 0.94A 3vlnA-1gnwA:
21.1		 3vlnA-1gnwA:
28.35
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.
3W67_D_VIVD301_0
(ALPHA-TOCOPHEROL
TRANSFER PROTEIN)		 6fai ESSENTIAL NUCLEAR
PROTEIN 1
(Saccharomyces
cerevisiae) 		5 / 12 LEU i 359
VAL i 326
LEU i 325
PHE i 323
LEU i 299
 None
None
None
None
U  21269 ( 4.5A)
 1.29A 3w67D-6faii:
undetectable		 3w67D-6faii:
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.
3WIP_G_ACHG301_0
(ACETYLCHOLINE-BINDIN
G PROTEIN)		 5xyi RIBOSOMAL PROTEIN
S3, PUTATIVE
PLECTIN/S10 DOMAIN
CONTAINING PROTEIN
(Trichomonas
vaginalis;
Trichomonas
vaginalis) 		4 / 8 TYR K  42
TYR K  65
ARG D  28
LEU D  25
 None
None
A  21245 ( 3.9A)
None
 1.08A 3wipG-5xyiK:
undetectable
3wipH-5xyiK:
undetectable		 3wipG-5xyiK:
21.98
3wipH-5xyiK:
21.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3WIP_J_ACHJ301_0
(ACETYLCHOLINE-BINDIN
G PROTEIN)		 5xyi RIBOSOMAL PROTEIN
S3, PUTATIVE
PLECTIN/S10 DOMAIN
CONTAINING PROTEIN
(Trichomonas
vaginalis;
Trichomonas
vaginalis) 		4 / 8 ARG D  28
LEU D  25
TYR K  42
TYR K  65
 A  21245 ( 3.9A)
None
None
None
 1.09A 3wipF-5xyiD:
undetectable
3wipJ-5xyiD:
undetectable		 3wipF-5xyiD:
20.66
3wipJ-5xyiD:
20.66
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.
4A7B_A_HAEA1273_1
(COLLAGENASE 3)		 3lmc PEPTIDASE,
ZINC-DEPENDENT
(Methanocorpuscul
um
labreanum) 		4 / 6 HIS A 149
GLU A 150
HIS A 153
HIS A 159
 ZN  A 212 (-3.4A)
ZN  A 212 ( 4.3A)
ZN  A 212 (-3.4A)
ZN  A 212 (-3.3A)
 0.34A 4a7bA-3lmcA:
6.7		 4a7bA-3lmcA:
22.52
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.
4BLV_B_SAMB1281_0
(RIBOSOMAL RNA LARGE
SUBUNIT
METHYLTRANSFERASE J)		 3cr3 PTS-DEPENDENT
DIHYDROXYACETONE
KINASE, ADP-BINDING
SUBUNIT DHAL
PTS-DEPENDENT
DIHYDROXYACETONE
KINASE,
PHOSPHOTRANSFERASE
SUBUNIT DHAM
(Lactococcus
lactis;
Lactococcus
lactis) 		5 / 12 HIS C  10
ASP A  36
HIS A  37
GLY A  33
LEU A  28
 None
MG  A1212 (-2.5A)
ADP  A1211 (-4.0A)
None
None
 0.97A 4blvB-3cr3C:
undetectable		 4blvB-3cr3C:
19.03
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.
4C1D_B_X8ZB350_1
(BETA-LACTAMASE CLASS
B VIM-2)		 2xf4 HYDROXYACYLGLUTATHIO
NE HYDROLASE
(Salmonella
enterica) 		5 / 10 HIS A  56
HIS A  58
ASP A  60
HIS A 132
HIS A 192
 None
PG4  A1212 ( 3.7A)
ZN  A1211 ( 2.8A)
None
ZN  A1211 (-3.3A)
 0.79A 4c1dB-2xf4A:
4.9		 4c1dB-2xf4A:
22.73
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.
4C1F_A_X8ZA300_1
(BETA-LACTAMASE IMP-1)		 2xf4 HYDROXYACYLGLUTATHIO
NE HYDROLASE
(Salmonella
enterica) 		5 / 11 HIS A  56
HIS A  58
ASP A  60
HIS A 132
HIS A 192
 None
PG4  A1212 ( 3.7A)
ZN  A1211 ( 2.8A)
None
ZN  A1211 (-3.3A)
 0.81A 4c1fA-2xf4A:
19.6
4c1fB-2xf4A:
6.3		 4c1fA-2xf4A:
23.36
4c1fB-2xf4A:
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.
4C1H_A_X8ZA305_1
(BETA-LACTAMASE 2)		 2xf4 HYDROXYACYLGLUTATHIO
NE HYDROLASE
(Salmonella
enterica) 		5 / 9 HIS A  56
HIS A  58
ASP A  60
HIS A 132
HIS A 192
 None
PG4  A1212 ( 3.7A)
ZN  A1211 ( 2.8A)
None
ZN  A1211 (-3.3A)
 0.77A 4c1hA-2xf4A:
20.2		 4c1hA-2xf4A:
22.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4C1H_A_X8ZA305_1
(BETA-LACTAMASE 2)		 2xf4 HYDROXYACYLGLUTATHIO
NE HYDROLASE
(Salmonella
enterica) 		5 / 9 HIS A  58
ASP A  60
HIS A  56
GLY A 159
HIS A 192
 PG4  A1212 ( 3.7A)
ZN  A1211 ( 2.8A)
None
None
ZN  A1211 (-3.3A)
 1.06A 4c1hA-2xf4A:
20.2		 4c1hA-2xf4A:
22.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4DF2_A_4CHA506_0
(NADPH DEHYDROGENASE)		 1wb8 SUPEROXIDE DISMUTASE
[FE]
(Sulfolobus
solfataricus) 		4 / 6 TYR A 187
HIS A  33
HIS A  84
TYR A  87
 None
FE  A 212 (-3.3A)
FE  A 212 (-3.3A)
None
 1.45A 4df2A-1wb8A:
undetectable		 4df2A-1wb8A:
18.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4EXS_B_X8ZB301_1
(BETA-LACTAMASE NDM-1)		 2xf4 HYDROXYACYLGLUTATHIO
NE HYDROLASE
(Salmonella
enterica) 		4 / 8 HIS A  58
ASP A  60
HIS A 132
HIS A 192
 PG4  A1212 ( 3.7A)
ZN  A1211 ( 2.8A)
None
ZN  A1211 (-3.3A)
 0.79A 4exsB-2xf4A:
18.5		 4exsB-2xf4A:
23.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4HYT_A_OBNA1104_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)		 6fai ESSENTIAL NUCLEAR
PROTEIN 1
(Saccharomyces
cerevisiae) 		5 / 12 LEU i 311
GLY i 339
ALA i 343
PHE i 371
LEU i 359
 None
None
G  21267 ( 3.2A)
None
None
 1.21A 4hytA-6faii:
undetectable		 4hytA-6faii:
5.99
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.
4K17_B_OHBB701_0
(LEUCINE-RICH
REPEAT-CONTAINING
PROTEIN 16A)		 4kqn D-HYDANTOINASE
(Bacillus
sp.
AR9) 		4 / 5 GLU A 185
ARG A 212
PRO A 289
SER A 241
 GLU  A 185 ( 0.5A)
ARG  A 212 ( 0.6A)
PRO  A 289 ( 1.1A)
SER  A 241 ( 0.0A)
 1.38A 4k17B-4kqnA:
undetectable		 4k17B-4kqnA:
20.96
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.
4K4Y_A_ACTA502_0
(RNA-DEPENDENT RNA
POLYMERASE)		 6fai ESSENTIAL NUCLEAR
PROTEIN 1
(Saccharomyces
cerevisiae) 		4 / 5 LYS i 264
LEU i 265
GLU i 261
LEU i 229
 C  21216 ( 4.8A)
None
None
None
 1.17A 4k4yA-6faii:
1.8		 4k4yA-6faii:
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.
4K4Y_E_ACTE503_0
(RNA-DEPENDENT RNA
POLYMERASE)		 6fai ESSENTIAL NUCLEAR
PROTEIN 1
(Saccharomyces
cerevisiae) 		4 / 4 LYS i 264
LEU i 265
GLU i 261
LEU i 229
 C  21216 ( 4.8A)
None
None
None
 1.19A 4k4yE-6faii:
1.5		 4k4yE-6faii:
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.
4K4Y_I_ACTI503_0
(RNA-DEPENDENT RNA
POLYMERASE)		 6fai ESSENTIAL NUCLEAR
PROTEIN 1
(Saccharomyces
cerevisiae) 		4 / 5 LYS i 264
LEU i 265
GLU i 261
LEU i 229
 C  21216 ( 4.8A)
None
None
None
 1.22A 4k4yI-6faii:
1.8		 4k4yI-6faii:
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.
4K7G_B_ACTB902_0
(3-HYDROXYPROLINE
DEHYDRATSE)		 2wt9 NICOTINAMIDASE
(Acinetobacter
baumannii) 		4 / 7 ASP A  54
ASP A 121
SER A  62
HIS A  89
 ZN  A1212 ( 2.6A)
ZN  A1212 ( 4.1A)
ZN  A1212 ( 4.4A)
ZN  A1212 ( 3.5A)
 0.98A 4k7gB-2wt9A:
undetectable		 4k7gB-2wt9A:
25.14
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.
4KN2_B_LYAB304_1
(FOLATE RECEPTOR BETA)		 1soj CGMP-INHIBITED
3',5'-CYCLIC
PHOSPHODIESTERASE B
(Homo
sapiens) 		5 / 12 ASP A 937
THR A 893
HIS A 825
ARG A 732
GLY A 730
 MG  A2123 (-2.5A)
None
None
None
None
 1.27A 4kn2B-1sojA:
0.0		 4kn2B-1sojA:
18.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4MDA_A_RLTA403_1
(MARINER MOS1
TRANSPOSASE)		 3cr3 PTS-DEPENDENT
DIHYDROXYACETONE
KINASE, ADP-BINDING
SUBUNIT DHAL
(Lactococcus
lactis) 		4 / 6 ASP A  36
ASP A  34
TYR A 164
ASP A  29
 MG  A1212 (-2.5A)
MG  A1213 (-2.7A)
None
MG  A1212 ( 2.6A)
 1.13A 4mdaA-3cr3A:
undetectable		 4mdaA-3cr3A:
22.17
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4MDB_A_RLTA401_1
(MARINER MOS1
TRANSPOSASE)		 3cr3 PTS-DEPENDENT
DIHYDROXYACETONE
KINASE, ADP-BINDING
SUBUNIT DHAL
(Lactococcus
lactis) 		4 / 6 ASP A  36
ASP A  34
TYR A 164
ASP A  29
 MG  A1212 (-2.5A)
MG  A1213 (-2.7A)
None
MG  A1212 ( 2.6A)
 1.06A 4mdbA-3cr3A:
undetectable		 4mdbA-3cr3A:
22.17
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4MX0_A_BCZA513_1
(NEURAMINIDASE)		 4r10 PROTEIN HUMPBACK-2
(Caenorhabditis
elegans) 		3 / 3 ARG A 271
ASP A 227
ARG A 306
 SEP  B1212 ( 4.2A)
None
SEP  B1212 ( 4.0A)
 0.82A 4mx0A-4r10A:
undetectable		 4mx0A-4r10A:
20.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4POO_B_SAMB301_0
(PUTATIVE RNA
METHYLASE)		 2wt9 NICOTINAMIDASE
(Acinetobacter
baumannii) 		5 / 12 GLY A  20
HIS A 100
ASP A  96
HIS A  56
SER A  62
 None
None
None
ZN  A1212 (-3.4A)
ZN  A1212 ( 4.4A)
 1.35A 4pooB-2wt9A:
4.2		 4pooB-2wt9A:
20.33
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4RET_A_DGXA1107_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)		 6fai ESSENTIAL NUCLEAR
PROTEIN 1
(Saccharomyces
cerevisiae) 		5 / 12 LEU i 311
GLY i 339
ALA i 343
PHE i 371
LEU i 359
 None
None
G  21267 ( 3.2A)
None
None
 1.18A 4retA-6faii:
undetectable		 4retA-6faii:
5.99
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.
4RET_C_DGXC2005_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)		 6fai ESSENTIAL NUCLEAR
PROTEIN 1
(Saccharomyces
cerevisiae) 		5 / 12 LEU i 311
GLY i 339
ALA i 343
PHE i 371
LEU i 359
 None
None
G  21267 ( 3.2A)
None
None
 1.17A 4retC-6faii:
undetectable		 4retC-6faii:
5.99
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.
4WNU_A_QDNA602_1
(CYTOCHROME P450 2D6)		 4mes THIAMINE TRANSPORTER
THIT
(Lactococcus
lactis) 		5 / 11 PHE A 124
GLY A  56
LEU A  57
LEU A  45
ALA A 117
 None
None
PEG  A 212 ( 4.5A)
None
None
 1.13A 4wnuA-4mesA:
undetectable		 4wnuA-4mesA:
17.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4WNW_A_RTZA602_1
(CYTOCHROME P450 2D6)		 5hiu GTPASE
ACTIVATOR-LIKE
PROTEIN
(Chaetomium
thermophilum) 		5 / 12 LEU A 212
LEU A 173
GLN A 185
THR A 193
PHE A 170
 LEU  A 212 ( 0.6A)
LEU  A 173 ( 0.5A)
GLN  A 185 ( 0.6A)
THR  A 193 ( 0.8A)
PHE  A 170 ( 1.3A)
 1.22A 4wnwA-5hiuA:
undetectable		 4wnwA-5hiuA:
22.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4XP9_C_1WEC706_1
(TRANSPORTER)		 3fhg N-GLYCOSYLASE/DNA
LYASE
(Sulfolobus
solfataricus) 		4 / 4 PHE A 140
ASP A 141
GLY A 138
SER A 189
 SO4  A 222 (-4.5A)
GOL  A 212 (-4.3A)
None
SO4  A 222 ( 3.6A)
 1.38A 4xp9C-3fhgA:
undetectable		 4xp9C-3fhgA:
17.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4XQG_A_AG2A505_1
(HOMOSPERMIDINE
SYNTHASE)		 3rnr STAGE II SPORULATION
E FAMILY PROTEIN
(Thermanaerovibri
o
acidaminovorans) 		4 / 8 ARG A 103
ASP A 162
ASP A  90
ASP A 107
 None
None
GOL  A 212 (-2.7A)
None
 0.95A 4xqgA-3rnrA:
undetectable		 4xqgA-3rnrA:
21.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4XQG_B_AG2B505_1
(HOMOSPERMIDINE
SYNTHASE)		 3rnr STAGE II SPORULATION
E FAMILY PROTEIN
(Thermanaerovibri
o
acidaminovorans) 		4 / 8 ARG A 103
ASP A 162
ASP A  90
ASP A 107
 None
None
GOL  A 212 (-2.7A)
None
 0.96A 4xqgB-3rnrA:
undetectable		 4xqgB-3rnrA:
21.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4Z3O_F_MFXF101_1
(DNA TOPOISOMERASE 4
SUBUNIT
B,PARE30-PARC55
FUSED TOPO IV FROM
S. PNEUMONIAE
E-SITE DNA)		 3w5n PUTATIVE
RHAMNOSIDASE
(Streptomyces
avermitilis) 		4 / 5 ARG A 320
GLY A  19
GLU A 109
SER A 595
 None
NA  A1212 ( 4.6A)
None
None
 1.09A 4z3oA-3w5nA:
undetectable
4z3oB-3w5nA:
2.3		 4z3oA-3w5nA:
21.00
4z3oB-3w5nA:
21.00
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.
4ZBQ_A_DIFA602_1
(SERUM ALBUMIN)		 2hk0 D-PSICOSE
3-EPIMERASE
(Agrobacterium
tumefaciens) 		4 / 8 ASP A 275
ASN A 278
ALA A 279
GLU A 212
 ASP  A 275 ( 0.6A)
ASN  A 278 ( 0.6A)
ALA  A 279 ( 0.0A)
GLU  A 212 ( 0.6A)
 0.90A 4zbqA-2hk0A:
undetectable		 4zbqA-2hk0A:
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.
5A06_D_SORD1343_0
(ALDOSE-ALDOSE
OXIDOREDUCTASE)		 5xyi RIBOSOMAL PROTEIN
S19E, PUTATIVE
(Trichomonas
vaginalis) 		4 / 5 ALA T  47
ARG T  63
HIS T  99
ALA T  88
 None
G  21289 ( 4.0A)
A  21331 ( 4.2A)
A  21332 ( 4.9A)
 1.18A 5a06C-5xyiT:
undetectable
5a06D-5xyiT:
undetectable		 5a06C-5xyiT:
18.08
5a06D-5xyiT:
18.08
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.
5A5Z_A_WJZA304_0
(BETA-LACTAMASE NDM-1)		 2xf4 HYDROXYACYLGLUTATHIO
NE HYDROLASE
(Salmonella
enterica) 		4 / 8 HIS A  58
ASP A  60
HIS A 132
HIS A 192
 PG4  A1212 ( 3.7A)
ZN  A1211 ( 2.8A)
None
ZN  A1211 (-3.3A)
 0.77A 5a5zA-2xf4A:
5.0		 5a5zA-2xf4A:
22.68
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.
5AYA_A_X8ZA307_1
(METALLO-BETA-LACTAMA
SE)		 2xf4 HYDROXYACYLGLUTATHIO
NE HYDROLASE
(Salmonella
enterica) 		6 / 11 HIS A  56
HIS A  58
ASP A  60
HIS A  61
HIS A 132
HIS A 192
 None
PG4  A1212 ( 3.7A)
ZN  A1211 ( 2.8A)
ZN  A1211 (-3.3A)
None
ZN  A1211 (-3.3A)
 0.48A 5ayaA-2xf4A:
17.5		 5ayaA-2xf4A:
24.00
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.
5BS8_G_MFXG101_1
(DNA GYRASE SUBUNIT A
DNA GYRASE SUBUNIT B
DNA SUBSTRATE 24-MER
TTACGTGCATAGTCATTCAT
GACC)		 3w5n PUTATIVE
RHAMNOSIDASE
(Streptomyces
avermitilis) 		4 / 7 ALA A 344
ARG A 320
GLY A  19
GLU A 109
 None
None
NA  A1212 ( 4.6A)
None
 0.89A 5bs8A-3w5nA:
3.2
5bs8C-3w5nA:
undetectable
5bs8D-3w5nA:
undetectable		 5bs8A-3w5nA:
20.89
5bs8C-3w5nA:
20.89
5bs8D-3w5nA:
13.54
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.
5BS8_H_MFXH101_1
(DNA GYRASE SUBUNIT A
DNA GYRASE SUBUNIT B
DNA SUBSTRATE 24-MER
GGTCATGAATGACTATGCAC
GTAA)		 3w5n PUTATIVE
RHAMNOSIDASE
(Streptomyces
avermitilis) 		4 / 7 ALA A 344
ARG A 320
GLY A  19
GLU A 109
 None
None
NA  A1212 ( 4.6A)
None
 0.85A 5bs8A-3w5nA:
3.2
5bs8B-3w5nA:
undetectable
5bs8C-3w5nA:
undetectable		 5bs8A-3w5nA:
20.89
5bs8B-3w5nA:
13.54
5bs8C-3w5nA:
20.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5BTD_E_GFNE101_1
(DNA GYRASE SUBUNIT A
DNA GYRASE SUBUNIT B
DNA SUBSTRATE 24-MER
GGTCATGAATGACTATGCAC
GTAA)		 3w5n PUTATIVE
RHAMNOSIDASE
(Streptomyces
avermitilis) 		4 / 7 ALA A 344
ARG A 320
GLY A  19
GLU A 109
 None
None
NA  A1212 ( 4.6A)
None
 0.87A 5btdA-3w5nA:
undetectable
5btdB-3w5nA:
undetectable
5btdC-3w5nA:
undetectable		 5btdA-3w5nA:
20.89
5btdB-3w5nA:
13.54
5btdC-3w5nA:
20.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5BTD_G_GFNG101_1
(DNA GYRASE SUBUNIT A
DNA GYRASE SUBUNIT B
DNA SUBSTRATE 24-MER
TTACGTGCATAGTCATTCAT
GACC)		 3w5n PUTATIVE
RHAMNOSIDASE
(Streptomyces
avermitilis) 		4 / 7 ALA A 344
ARG A 320
GLY A  19
GLU A 109
 None
None
NA  A1212 ( 4.6A)
None
 0.92A 5btdA-3w5nA:
undetectable
5btdC-3w5nA:
undetectable
5btdD-3w5nA:
undetectable		 5btdA-3w5nA:
20.89
5btdC-3w5nA:
20.89
5btdD-3w5nA:
13.54
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.
5BTG_E_LFXE101_1
(DNA GYRASE SUBUNIT A
DNA GYRASE SUBUNIT B
DNA SUBSTRATE 24-MER
GGTCATGAATGACTATGCAC
GTAA)		 3w5n PUTATIVE
RHAMNOSIDASE
(Streptomyces
avermitilis) 		4 / 6 ALA A 344
ARG A 320
GLY A  19
GLU A 109
 None
None
NA  A1212 ( 4.6A)
None
 0.87A 5btgA-3w5nA:
undetectable
5btgB-3w5nA:
undetectable
5btgC-3w5nA:
undetectable		 5btgA-3w5nA:
20.89
5btgB-3w5nA:
13.54
5btgC-3w5nA:
20.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5BTI_F_LFXF101_1
(DNA GYRASE SUBUNIT A
DNA GYRASE SUBUNIT B
DNA SUBSTRATE 24-MER
TTACGTGCATAGTCATTCAT
GACC)		 5xyi 40S RIBOSOMAL
PROTEIN S16,
PUTATIVE
RIBOSOMAL PROTEIN
S10P/S20E, PUTATIVE
(Trichomonas
vaginalis) 		4 / 5 ARG Q 135
GLY Q 128
THR U  78
GLU U  79
 U  21275 ( 3.5A)
None
U  21090 ( 3.6A)
C  21005 ( 3.5A)
 1.09A 5btiC-5xyiQ:
undetectable
5btiD-5xyiQ:
undetectable		 5btiC-5xyiQ:
15.50
5btiD-5xyiQ:
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.
5ERM_A_210A401_1
(FUSICOCCADIENE
SYNTHASE)		 5dz2 GERMACRADIENOL/GEOSM
IN SYNTHASE
(Streptomyces
coelicolor) 		6 / 10 ASP A  86
ARG A 184
ASN A 229
SER A 233
GLU A 237
ARG A 325
 MG  A 401 (-2.5A)
212  A 404 (-3.6A)
MG  A 402 ( 2.6A)
MG  A 402 ( 2.5A)
MG  A 402 ( 2.7A)
212  A 404 (-4.0A)
 0.71A 5ermA-5dz2A:
23.0		 5ermA-5dz2A:
21.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ERM_A_210A401_1
(FUSICOCCADIENE
SYNTHASE)		 5dz2 GERMACRADIENOL/GEOSM
IN SYNTHASE
(Streptomyces
coelicolor) 		6 / 10 ASP A  86
ASN A 229
SER A 233
GLU A 237
ARG A 325
TYR A 326
 MG  A 401 (-2.5A)
MG  A 402 ( 2.6A)
MG  A 402 ( 2.5A)
MG  A 402 ( 2.7A)
212  A 404 (-4.0A)
212  A 404 (-4.3A)
 0.52A 5ermA-5dz2A:
23.0		 5ermA-5dz2A:
21.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ERM_B_210B704_1
(FUSICOCCADIENE
SYNTHASE)		 5dz2 GERMACRADIENOL/GEOSM
IN SYNTHASE
(Streptomyces
coelicolor) 		7 / 9 ASP A  86
ARG A 184
ASN A 229
SER A 233
GLU A 237
ARG A 325
TYR A 326
 MG  A 401 (-2.5A)
212  A 404 (-3.6A)
MG  A 402 ( 2.6A)
MG  A 402 ( 2.5A)
MG  A 402 ( 2.7A)
212  A 404 (-4.0A)
212  A 404 (-4.3A)
 0.66A 5ermB-5dz2A:
10.9		 5ermB-5dz2A:
21.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5HFJ_E_SAME301_0
(ADENINE SPECIFIC DNA
METHYLTRANSFERASE
(DPNA))		 5xyi GUANINE
NUCLEOTIDE-BINDING
PROTEIN BETA
SUBUNIT, PUTATIVE
(Trichomonas
vaginalis) 		5 / 12 ASP g  54
ALA g  34
GLY g 321
SER g 320
SER g  52
 G  21218 ( 4.9A)
None
None
None
None
 1.27A 5hfjE-5xyig:
undetectable		 5hfjE-5xyig:
20.53
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.
5HNZ_B_TA1B902_2
(TUBULIN BETA-2B
CHAIN)		 2bv7 GLYCOLIPID TRANSFER
PROTEIN
(Bos
taurus) 		3 / 3 LEU A 101
LEU A  30
ARG A 181
 None
GM3  A1212 ( 4.8A)
None
 0.58A 5hnzB-2bv7A:
undetectable		 5hnzB-2bv7A:
16.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5KLA_A_ACTA1505_0
(MATERNAL PROTEIN
PUMILIO)		 2wt9 NICOTINAMIDASE
(Acinetobacter
baumannii) 		3 / 3 HIS A  89
LYS A  88
PHE A  63
 ZN  A1212 ( 3.5A)
None
None
 1.32A 5klaA-2wt9A:
undetectable		 5klaA-2wt9A:
18.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5L6E_A_SAMA601_0
(N6-ADENOSINE-METHYLT
RANSFERASE 70 KDA
SUBUNIT)		 2xcm CYTOSOLIC HEAT SHOCK
PROTEIN 90
(Hordeum
vulgare) 		5 / 12 ILE A 119
LEU A 110
PHE A 106
GLY A 123
GLY A 120
 None
None
None
ADP  A1211 (-2.9A)
MG  A1212 ( 4.9A)
 1.18A 5l6eA-2xcmA:
undetectable		 5l6eA-2xcmA:
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.
5M45_A_ACTA803_0
(ACETONE CARBOXYLASE
ALPHA SUBUNIT)		 5it9 RIBOSOMAL PROTEIN
ES10
RIBOSOMAL PROTEIN
ES29
(Kluyveromyces
lactis;
Kluyveromyces
lactis) 		4 / 4 GLU d   4
PRO K   4
ILE K   3
LEU K   2
 U  21231 ( 4.5A)
None
U  21256 ( 4.6A)
U  21231 ( 4.1A)
 1.12A 5m45A-5it9d:
undetectable		 5m45A-5it9d:
5.68
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.
5M45_D_ACTD803_0
(ACETONE CARBOXYLASE
ALPHA SUBUNIT)		 5it9 RIBOSOMAL PROTEIN
ES10
RIBOSOMAL PROTEIN
ES29
(Kluyveromyces
lactis;
Kluyveromyces
lactis) 		4 / 4 GLU d   4
PRO K   4
ILE K   3
LEU K   2
 U  21231 ( 4.5A)
None
U  21256 ( 4.6A)
U  21231 ( 4.1A)
 1.10A 5m45D-5it9d:
undetectable		 5m45D-5it9d:
5.68
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.
5M45_G_ACTG803_0
(ACETONE CARBOXYLASE
ALPHA SUBUNIT)		 5it9 RIBOSOMAL PROTEIN
ES10
RIBOSOMAL PROTEIN
ES29
(Kluyveromyces
lactis;
Kluyveromyces
lactis) 		4 / 4 GLU d   4
PRO K   4
ILE K   3
LEU K   2
 U  21231 ( 4.5A)
None
U  21256 ( 4.6A)
U  21231 ( 4.1A)
 1.10A 5m45G-5it9d:
undetectable		 5m45G-5it9d:
5.68
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.
5M45_J_ACTJ803_0
(ACETONE CARBOXYLASE
ALPHA SUBUNIT)		 5it9 RIBOSOMAL PROTEIN
ES10
RIBOSOMAL PROTEIN
ES29
(Kluyveromyces
lactis;
Kluyveromyces
lactis) 		4 / 4 GLU d   4
PRO K   4
ILE K   3
LEU K   2
 U  21231 ( 4.5A)
None
U  21256 ( 4.6A)
U  21231 ( 4.1A)
 1.13A 5m45J-5it9d:
undetectable		 5m45J-5it9d:
5.68
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.
5MZR_A_PFLA412_1
(PROTON-GATED ION
CHANNEL)		 5wpi HSVA
(Erwinia
amylovora) 		5 / 10 PRO A 273
ILE A 212
MET A 207
VAL A 262
ILE A 366
 PRO  A 273 ( 1.1A)
ILE  A 212 ( 0.6A)
MET  A 207 ( 0.0A)
VAL  A 262 ( 0.6A)
ILE  A 366 ( 0.7A)
 1.40A 5mzrA-5wpiA:
undetectable		 5mzrA-5wpiA:
14.32
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.
5MZR_C_PFLC409_1
(PROTON-GATED ION
CHANNEL)		 5wpi HSVA
(Erwinia
amylovora) 		5 / 10 PRO A 273
ILE A 212
MET A 207
VAL A 262
ILE A 366
 PRO  A 273 ( 1.1A)
ILE  A 212 ( 0.6A)
MET  A 207 ( 0.0A)
VAL  A 262 ( 0.6A)
ILE  A 366 ( 0.7A)
 1.40A 5mzrC-5wpiA:
undetectable		 5mzrC-5wpiA:
14.32
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.
5MZR_D_PFLD410_1
(PROTON-GATED ION
CHANNEL)		 5wpi HSVA
(Erwinia
amylovora) 		5 / 9 PRO A 273
ILE A 212
MET A 207
VAL A 262
ILE A 366
 PRO  A 273 ( 1.1A)
ILE  A 212 ( 0.6A)
MET  A 207 ( 0.0A)
VAL  A 262 ( 0.6A)
ILE  A 366 ( 0.7A)
 1.42A 5mzrD-5wpiA:
undetectable		 5mzrD-5wpiA:
14.32
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.
5N0O_A_SAMA501_0
(PEPTIDE
N-METHYLTRANSFERASE)		 2p8j S-ADENOSYLMETHIONINE
-DEPENDENT
METHYLTRANSFERASE
(Clostridium
acetobutylicum) 		5 / 12 ILE A  74
GLY A  50
VAL A  26
VAL A  92
ALA A  61
 GOL  A 212 (-3.8A)
None
None
None
None
 1.07A 5n0oA-2p8jA:
undetectable		 5n0oA-2p8jA:
21.04
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.
5N0R_A_SAMA501_0
(PEPTIDE
N-METHYLTRANSFERASE)		 2p8j S-ADENOSYLMETHIONINE
-DEPENDENT
METHYLTRANSFERASE
(Clostridium
acetobutylicum) 		5 / 12 ILE A  74
GLY A  50
VAL A  26
VAL A  92
ALA A  61
 GOL  A 212 (-3.8A)
None
None
None
None
 1.05A 5n0rA-2p8jA:
undetectable		 5n0rA-2p8jA:
19.57
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.
5N0T_A_SAMA501_0
(PEPTIDE
N-METHYLTRANSFERASE)		 2p8j S-ADENOSYLMETHIONINE
-DEPENDENT
METHYLTRANSFERASE
(Clostridium
acetobutylicum) 		5 / 12 ILE A  74
GLY A  50
VAL A  26
VAL A  92
ALA A  61
 GOL  A 212 (-3.8A)
None
None
None
None
 1.07A 5n0tA-2p8jA:
undetectable		 5n0tA-2p8jA:
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.
5N0W_A_SAMA501_0
(PEPTIDE
N-METHYLTRANSFERASE)		 2p8j S-ADENOSYLMETHIONINE
-DEPENDENT
METHYLTRANSFERASE
(Clostridium
acetobutylicum) 		5 / 12 ILE A  74
GLY A  50
VAL A  26
VAL A  92
ALA A  61
 GOL  A 212 (-3.8A)
None
None
None
None
 1.07A 5n0wA-2p8jA:
undetectable		 5n0wA-2p8jA:
19.57
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.
5N0W_B_SAMB501_0
(PEPTIDE
N-METHYLTRANSFERASE)		 2p8j S-ADENOSYLMETHIONINE
-DEPENDENT
METHYLTRANSFERASE
(Clostridium
acetobutylicum) 		5 / 12 ILE A  74
GLY A  50
VAL A  26
VAL A  92
ALA A  61
 GOL  A 212 (-3.8A)
None
None
None
None
 1.08A 5n0wB-2p8jA:
undetectable		 5n0wB-2p8jA:
19.57
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.
5N4I_A_SAMA501_0
(PEPTIDE
N-METHYLTRANSFERASE)		 2p8j S-ADENOSYLMETHIONINE
-DEPENDENT
METHYLTRANSFERASE
(Clostridium
acetobutylicum) 		5 / 12 ILE A  74
GLY A  50
VAL A  26
VAL A  92
ALA A  61
 GOL  A 212 (-3.8A)
None
None
None
None
 1.06A 5n4iA-2p8jA:
undetectable		 5n4iA-2p8jA:
19.57
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.
5N5J_A_HAEA306_1
(MACROPHAGE
METALLOELASTASE)		 3lmc PEPTIDASE,
ZINC-DEPENDENT
(Methanocorpuscul
um
labreanum) 		4 / 4 HIS A 149
GLU A 150
HIS A 153
HIS A 159
 ZN  A 212 (-3.4A)
ZN  A 212 ( 4.3A)
ZN  A 212 (-3.4A)
ZN  A 212 (-3.3A)
 0.23A 5n5jA-3lmcA:
8.2		 5n5jA-3lmcA:
23.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5N5K_A_HAEA306_1
(MACROPHAGE
METALLOELASTASE)		 3lmc PEPTIDASE,
ZINC-DEPENDENT
(Methanocorpuscul
um
labreanum) 		4 / 5 HIS A 149
GLU A 150
HIS A 153
HIS A 159
 ZN  A 212 (-3.4A)
ZN  A 212 ( 4.3A)
ZN  A 212 (-3.4A)
ZN  A 212 (-3.3A)
 0.22A 5n5kA-3lmcA:
8.3		 5n5kA-3lmcA:
26.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ND7_B_TA1B601_1
(TUBULIN BETA-2B
CHAIN)		 5wvc CASPASE
(Homo
sapiens) 		5 / 12 ASP D 223
LEU D 289
LEU D 216
ALA D 255
LEU D 229
 None
None
CSO  D 212 ( 3.4A)
None
None
 1.12A 5nd7B-5wvcD:
undetectable		 5nd7B-5wvcD:
15.33
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.
5NZW_A_9F2A1102_1
(DNA CROSS-LINK
REPAIR 1A PROTEIN)		 2xf4 HYDROXYACYLGLUTATHIO
NE HYDROLASE
(Salmonella
enterica) 		5 / 10 HIS A  56
HIS A  58
HIS A  61
HIS A 132
ASP A 151
 None
PG4  A1212 ( 3.7A)
ZN  A1211 (-3.3A)
None
ZN  A1211 (-2.4A)
 0.51A 5nzwA-2xf4A:
2.4		 5nzwA-2xf4A:
21.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5OEX_A_CUA604_0
(THIOCYANATE
DEHYDROGENASE)		 1soj CGMP-INHIBITED
3',5'-CYCLIC
PHOSPHODIESTERASE B
(Homo
sapiens) 		3 / 3 HIS A 741
HIS A 737
HIS A 825
 MG  A2123 (-3.0A)
IBM  A2111 ( 4.8A)
None
 1.00A 5oexA-1sojA:
undetectable		 5oexA-1sojA:
21.44
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.
5TDZ_A_ADNA905_1
(ATP-CITRATE SYNTHASE)		 2btd PTS-DEPENDENT
DIHYDROXYACETONE
KINASE
(Escherichia
coli) 		4 / 6 THR A 195
ASP A 191
LEU A  29
ASP A  30
 None
ADP  A1211 (-2.5A)
None
MG  A1212 ( 2.3A)
 1.10A 5tdzA-2btdA:
undetectable		 5tdzA-2btdA:
19.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5UC3_A_486A801_2
(GLUCOCORTICOID
RECEPTOR)		 3rf0 EXOPOLYPHOSPHATASE
(Yersinia
pestis) 		4 / 5 LEU A  55
LEU A  98
GLN A  49
TYR A 124
 None
None
NO3  A 212 (-3.6A)
NO3  A 212 (-4.0A)
 1.27A 5uc3A-3rf0A:
3.2		 5uc3A-3rf0A:
17.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5V5Z_A_1YNA602_2
(LANOSTEROL 14-ALPHA
DEMETHYLASE)		 2w7z PENTAPEPTIDE REPEAT
FAMILY PROTEIN
(Enterococcus
faecalis) 		3 / 3 GLY A 207
THR A 167
PRO A 186
 None
None
CL  A1212 ( 4.1A)
 0.65A 5v5zA-2w7zA:
undetectable		 5v5zA-2w7zA:
17.96
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.
5VLM_F_CVIF301_0
(REGULATORY PROTEIN
TETR)		 2xf4 HYDROXYACYLGLUTATHIO
NE HYDROLASE
(Salmonella
enterica) 		5 / 12 MET A  96
ALA A  92
GLY A  89
LEU A  59
ASP A  83
 PG4  A1212 ( 3.9A)
PG4  A1212 (-3.7A)
None
None
None
 1.30A 5vlmF-2xf4A:
undetectable		 5vlmF-2xf4A:
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.
5X1F_N_CUN603_0
(CYTOCHROME C OXIDASE
SUBUNIT 1)		 3lmc PEPTIDASE,
ZINC-DEPENDENT
(Methanocorpuscul
um
labreanum) 		3 / 3 HIS A 159
HIS A 153
HIS A 149
 ZN  A 212 (-3.3A)
ZN  A 212 (-3.4A)
ZN  A 212 (-3.4A)
 0.68A 5x1fN-3lmcA:
undetectable		 5x1fN-3lmcA:
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.
5YK2_A_ERYA501_0
(PROBABLE CONSERVED
ATP-BINDING PROTEIN
ABC TRANSPORTER)		 3qz5 CO-TYPE NITRILE
HYDRATASE ALPHA
SUBUNIT
(Pseudomonas
putida) 		5 / 11 ARG A 138
GLY A  13
ASP A  12
ALA A 132
PRO A 127
 None
GOL  A 212 ( 3.9A)
None
GOL  A 212 ( 3.8A)
None
 1.08A 5yk2A-3qz5A:
undetectable		 5yk2A-3qz5A:
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.
5YK2_A_ERYA501_0
(PROBABLE CONSERVED
ATP-BINDING PROTEIN
ABC TRANSPORTER)		 3qz5 CO-TYPE NITRILE
HYDRATASE ALPHA
SUBUNIT
(Pseudomonas
putida) 		5 / 11 GLY A  13
ASP A  12
ALA A 132
ALA A 128
PRO A 127
 GOL  A 212 ( 3.9A)
None
GOL  A 212 ( 3.8A)
None
None
 1.15A 5yk2A-3qz5A:
undetectable		 5yk2A-3qz5A:
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.
5Z0F_B_DAHB98_0
(MELC
TYROSINASE)		 3uss PUTATIVE
UNCHARACTERIZED
PROTEIN
(Pseudomonas
aeruginosa) 		5 / 11 HIS A 142
HIS A  91
HIS A 157
VAL A 131
SER A 106
 FE2  A 212 (-3.3A)
FE2  A 212 ( 3.2A)
SO4  A 215 (-4.1A)
None
None
 1.18A 5z0fA-3ussA:
undetectable
5z0fB-3ussA:
undetectable		 5z0fA-3ussA:
17.54
5z0fB-3ussA:
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.
5Z0F_B_DAHB98_0
(MELC
TYROSINASE)		 3uss PUTATIVE
UNCHARACTERIZED
PROTEIN
(Pseudomonas
aeruginosa) 		5 / 11 HIS A 157
HIS A  91
HIS A 142
VAL A  88
SER A 106
 SO4  A 215 (-4.1A)
FE2  A 212 ( 3.2A)
FE2  A 212 (-3.3A)
None
None
 1.32A 5z0fA-3ussA:
undetectable
5z0fB-3ussA:
undetectable		 5z0fA-3ussA:
17.54
5z0fB-3ussA:
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.
5Z0G_B_DAHB98_0
(MELC
TYROSINASE)		 3uss PUTATIVE
UNCHARACTERIZED
PROTEIN
(Pseudomonas
aeruginosa) 		5 / 11 HIS A 142
HIS A  91
HIS A 157
VAL A 131
SER A 106
 FE2  A 212 (-3.3A)
FE2  A 212 ( 3.2A)
SO4  A 215 (-4.1A)
None
None
 1.18A 5z0gA-3ussA:
undetectable
5z0gB-3ussA:
undetectable		 5z0gA-3ussA:
17.54
5z0gB-3ussA:
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.
5Z0G_B_DAHB98_0
(MELC
TYROSINASE)		 3uss PUTATIVE
UNCHARACTERIZED
PROTEIN
(Pseudomonas
aeruginosa) 		5 / 11 HIS A 157
HIS A  91
HIS A 142
VAL A  88
SER A 106
 SO4  A 215 (-4.1A)
FE2  A 212 ( 3.2A)
FE2  A 212 (-3.3A)
None
None
 1.32A 5z0gA-3ussA:
undetectable
5z0gB-3ussA:
undetectable		 5z0gA-3ussA:
17.54
5z0gB-3ussA:
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.
5Z0H_B_DAHB98_0
(MELC
TYROSINASE)		 3uss PUTATIVE
UNCHARACTERIZED
PROTEIN
(Pseudomonas
aeruginosa) 		5 / 11 HIS A 142
HIS A  91
HIS A 157
VAL A 131
SER A 106
 FE2  A 212 (-3.3A)
FE2  A 212 ( 3.2A)
SO4  A 215 (-4.1A)
None
None
 1.14A 5z0hA-3ussA:
undetectable
5z0hB-3ussA:
undetectable		 5z0hA-3ussA:
17.54
5z0hB-3ussA:
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.
5Z0I_B_DAHB98_0
(MELC
TYROSINASE)		 3uss PUTATIVE
UNCHARACTERIZED
PROTEIN
(Pseudomonas
aeruginosa) 		5 / 11 HIS A 142
HIS A  91
HIS A 157
VAL A 131
SER A 106
 FE2  A 212 (-3.3A)
FE2  A 212 ( 3.2A)
SO4  A 215 (-4.1A)
None
None
 1.14A 5z0iA-3ussA:
undetectable
5z0iB-3ussA:
undetectable		 5z0iA-3ussA:
17.54
5z0iB-3ussA:
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.
5Z0I_B_DAHB98_0
(MELC
TYROSINASE)		 3uss PUTATIVE
UNCHARACTERIZED
PROTEIN
(Pseudomonas
aeruginosa) 		5 / 11 HIS A 157
HIS A  91
HIS A 142
VAL A  88
SER A 106
 SO4  A 215 (-4.1A)
FE2  A 212 ( 3.2A)
FE2  A 212 (-3.3A)
None
None
 1.32A 5z0iA-3ussA:
undetectable
5z0iB-3ussA:
undetectable		 5z0iA-3ussA:
17.54
5z0iB-3ussA:
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.
5Z0J_B_DAHB98_0
(MELC
TYROSINASE)		 3uss PUTATIVE
UNCHARACTERIZED
PROTEIN
(Pseudomonas
aeruginosa) 		5 / 11 HIS A 142
HIS A  91
HIS A 157
VAL A 131
SER A 106
 FE2  A 212 (-3.3A)
FE2  A 212 ( 3.2A)
SO4  A 215 (-4.1A)
None
None
 1.19A 5z0jA-3ussA:
undetectable
5z0jB-3ussA:
undetectable		 5z0jA-3ussA:
17.54
5z0jB-3ussA:
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.
5Z0K_B_DAHB98_0
(MELC
TYROSINASE)		 3uss PUTATIVE
UNCHARACTERIZED
PROTEIN
(Pseudomonas
aeruginosa) 		5 / 11 HIS A 142
HIS A  91
HIS A 157
VAL A 131
SER A 106
 FE2  A 212 (-3.3A)
FE2  A 212 ( 3.2A)
SO4  A 215 (-4.1A)
None
None
 1.18A 5z0kA-3ussA:
undetectable
5z0kB-3ussA:
undetectable		 5z0kA-3ussA:
17.54
5z0kB-3ussA:
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.
5Z0L_B_DAHB98_0
(MELC
TYROSINASE)		 3uss PUTATIVE
UNCHARACTERIZED
PROTEIN
(Pseudomonas
aeruginosa) 		5 / 11 HIS A 142
HIS A  91
HIS A 157
VAL A 131
SER A 106
 FE2  A 212 (-3.3A)
FE2  A 212 ( 3.2A)
SO4  A 215 (-4.1A)
None
None
 1.12A 5z0lA-3ussA:
undetectable
5z0lB-3ussA:
undetectable		 5z0lA-3ussA:
17.54
5z0lB-3ussA:
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.
5Z0L_B_DAHB98_0
(MELC
TYROSINASE)		 3uss PUTATIVE
UNCHARACTERIZED
PROTEIN
(Pseudomonas
aeruginosa) 		5 / 11 HIS A 157
HIS A  91
HIS A 142
VAL A  88
SER A 106
 SO4  A 215 (-4.1A)
FE2  A 212 ( 3.2A)
FE2  A 212 (-3.3A)
None
None
 1.33A 5z0lA-3ussA:
undetectable
5z0lB-3ussA:
undetectable		 5z0lA-3ussA:
17.54
5z0lB-3ussA:
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.
5Z0M_B_DAHB98_0
(MELC
TYROSINASE)		 3uss PUTATIVE
UNCHARACTERIZED
PROTEIN
(Pseudomonas
aeruginosa) 		5 / 11 HIS A 142
HIS A  91
HIS A 157
VAL A 131
SER A 106
 FE2  A 212 (-3.3A)
FE2  A 212 ( 3.2A)
SO4  A 215 (-4.1A)
None
None
 1.14A 5z0mA-3ussA:
undetectable
5z0mB-3ussA:
undetectable		 5z0mA-3ussA:
17.54
5z0mB-3ussA:
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.
5ZJ8_A_9DCA303_0
(METALLO-BETA-LACTAMA
SE TYPE 2)		 2xf4 HYDROXYACYLGLUTATHIO
NE HYDROLASE
(Salmonella
enterica) 		4 / 8 HIS A  58
ASP A  60
HIS A 132
HIS A 192
 PG4  A1212 ( 3.7A)
ZN  A1211 ( 2.8A)
None
ZN  A1211 (-3.3A)
 0.84A 5zj8A-2xf4A:
18.7		 5zj8A-2xf4A:
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.
6B58_A_ACTA609_0
(FUMARATE REDUCTASE
FLAVOPROTEIN SUBUNIT)		 3uss PUTATIVE
UNCHARACTERIZED
PROTEIN
(Pseudomonas
aeruginosa) 		3 / 3 HIS A 142
HIS A  89
ARG A 168
 FE2  A 212 (-3.3A)
FE2  A 212 ( 3.2A)
SO4  A 215 (-2.9A)
 0.97A 6b58A-3ussA:
undetectable		 6b58A-3ussA:
16.76
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.
6CI6_A_NBOA607_1
(SERUM ALBUMIN)		 2hk0 D-PSICOSE
3-EPIMERASE
(Agrobacterium
tumefaciens) 		4 / 7 ASP A 275
ASN A 278
ALA A 279
GLU A 212
 ASP  A 275 ( 0.6A)
ASN  A 278 ( 0.6A)
ALA  A 279 ( 0.0A)
GLU  A 212 ( 0.6A)
 0.84A 6ci6A-2hk0A:
undetectable		 6ci6A-2hk0A:
11.66
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.
6CLX_A_SAMA401_0
(O-METHYLTRANSFERASE)		 2r01 NITROREDUCTASE
FAMILY PROTEIN
(Chlorobaculum
tepidum) 		5 / 12 TRP A  77
ALA A 117
GLY A 131
ARG A  25
PHE A  27
 None
None
None
FMN  A 212 (-3.8A)
None
 1.25A 6clxA-2r01A:
undetectable		 6clxA-2r01A:
23.26
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.
6DCH_A_ACTA401_0
(SCOE PROTEIN)		 1soj CGMP-INHIBITED
3',5'-CYCLIC
PHOSPHODIESTERASE B
(Homo
sapiens) 		4 / 5 THR A 829
HIS A 825
ASP A 822
HIS A 854
 None
None
MG  A2124 ( 2.4A)
None
 1.43A 6dchA-1sojA:
undetectable		 6dchA-1sojA:
21.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6F32_B_ACTB602_0
(AMINE OXIDASE LKCE)		 3cvo METHYLTRANSFERASE-LI
KE PROTEIN OF
UNKNOWN FUNCTION
(Ruegeria
pomeroyi) 		4 / 6 ASN A  82
VAL A  84
VAL A 113
THR A 116
 EDO  A 212 (-3.8A)
None
None
EDO  A 212 ( 3.9A)
 1.17A 6f32B-3cvoA:
3.4		 6f32B-3cvoA:
17.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6HU9_S_PCFS603_0
(CYTOCHROME B-C1
COMPLEX SUBUNIT 8
CYTOCHROME C OXIDASE
POLYPEPTIDE 5A,
MITOCHONDRIAL)		 3lmc PEPTIDASE,
ZINC-DEPENDENT
(Methanocorpuscul
um
labreanum) 		4 / 7 GLY A 156
PHE A 155
HIS A 153
LYS A  90
 None
None
ZN  A 212 (-3.4A)
None
 1.03A 6hu9S-3lmcA:
undetectable
6hu9q-3lmcA:
undetectable		 6hu9S-3lmcA:
19.59
6hu9q-3lmcA:
20.57
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.
6NMP_J_CHDJ101_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 7A1,
MITOCHONDRIAL)		 2bv7 GLYCOLIPID TRANSFER
PROTEIN
(Bos
taurus) 		4 / 7 ILE A 111
LEU A 108
ARG A 125
LEU A  37
 None
GM3  A1212 ( 4.9A)
None
None
 0.91A 6nmpA-2bv7A:
2.2
6nmpJ-2bv7A:
undetectable		 6nmpA-2bv7A:
18.09
6nmpJ-2bv7A:
15.38
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.
6NMP_W_CHDW101_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 7A1,
MITOCHONDRIAL)		 2bv7 GLYCOLIPID TRANSFER
PROTEIN
(Bos
taurus) 		4 / 5 ILE A 111
LEU A 108
ARG A 125
LEU A  37
 None
GM3  A1212 ( 4.9A)
None
None
 0.92A 6nmpN-2bv7A:
1.9
6nmpW-2bv7A:
undetectable		 6nmpN-2bv7A:
18.09
6nmpW-2bv7A:
15.38