SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '17E'


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.
1A4L_A_DCFA353_1
(ADENOSINE DEAMINASE)		 4r85 CYTOSINE DEAMINASE
(Klebsiella
pneumoniae) 		7 / 12 HIS A  56
HIS A  58
ASP A  60
HIS A 209
GLU A 212
HIS A 241
ASP A 308
 FE2  A 502 (-3.4A)
FE2  A 502 ( 3.5A)
None
FE2  A 502 ( 3.4A)
17E  A 501 (-2.9A)
FE2  A 502 ( 3.7A)
FE2  A 502 ( 2.8A)
 0.87A 1a4lA-4r85A:
22.6		 1a4lA-4r85A:
20.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1A4L_B_DCFB853_1
(ADENOSINE DEAMINASE)		 4r85 CYTOSINE DEAMINASE
(Klebsiella
pneumoniae) 		5 / 12 ASP A  60
HIS A 209
GLU A 212
HIS A 241
ASP A 308
 None
FE2  A 502 ( 3.4A)
17E  A 501 (-2.9A)
FE2  A 502 ( 3.7A)
FE2  A 502 ( 2.8A)
 0.73A 1a4lB-4r85A:
22.8		 1a4lB-4r85A:
20.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1A4L_B_DCFB853_1
(ADENOSINE DEAMINASE)		 4r85 CYTOSINE DEAMINASE
(Klebsiella
pneumoniae) 		5 / 12 HIS A  58
ASP A  60
HIS A 209
GLU A 212
ASP A 308
 FE2  A 502 ( 3.5A)
None
FE2  A 502 ( 3.4A)
17E  A 501 (-2.9A)
FE2  A 502 ( 2.8A)
 0.89A 1a4lB-4r85A:
22.8		 1a4lB-4r85A:
20.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1A4L_C_DCFC1353_1
(ADENOSINE DEAMINASE)		 4r85 CYTOSINE DEAMINASE
(Klebsiella
pneumoniae) 		7 / 12 HIS A  56
HIS A  58
ASP A  60
HIS A 209
GLU A 212
HIS A 241
ASP A 308
 FE2  A 502 (-3.4A)
FE2  A 502 ( 3.5A)
None
FE2  A 502 ( 3.4A)
17E  A 501 (-2.9A)
FE2  A 502 ( 3.7A)
FE2  A 502 ( 2.8A)
 0.85A 1a4lC-4r85A:
22.7		 1a4lC-4r85A:
20.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1A4L_D_DCFD1853_1
(ADENOSINE DEAMINASE)		 4r85 CYTOSINE DEAMINASE
(Klebsiella
pneumoniae) 		6 / 12 HIS A  58
ASP A  60
HIS A 209
GLU A 212
HIS A 241
ASP A 308
 FE2  A 502 ( 3.5A)
None
FE2  A 502 ( 3.4A)
17E  A 501 (-2.9A)
FE2  A 502 ( 3.7A)
FE2  A 502 ( 2.8A)
 0.91A 1a4lD-4r85A:
22.6		 1a4lD-4r85A:
20.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1GXS_C_BEZC602_0
(P-(S)-HYDROXYMANDELO
NITRILE LYASE CHAIN
A
P-(S)-HYDROXYMANDELO
NITRILE LYASE CHAIN
B)		 4r85 CYTOSINE DEAMINASE
(Klebsiella
pneumoniae) 		5 / 9 PRO A 313
ASP A  60
SER A 309
HIS A  58
TRP A  83
 None
None
17E  A 501 (-3.2A)
FE2  A 502 ( 3.5A)
None
 1.46A 1gxsC-4r85A:
undetectable
1gxsD-4r85A:
0.8		 1gxsC-4r85A:
23.06
1gxsD-4r85A:
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.
1WG8_B_SAMB3141_1
(PREDICTED
S-ADENOSYLMETHIONINE
-DEPENDENT
METHYLTRANSFERASE)		 4r85 CYTOSINE DEAMINASE
(Klebsiella
pneumoniae) 		3 / 3 HIS A 117
ASP A 312
ASN A  71
 None
17E  A 501 ( 4.4A)
None
 0.69A 1wg8B-4r85A:
undetectable		 1wg8B-4r85A:
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.
2DTT_D_H4BD1006_1
(HYPOTHETICAL PROTEIN
PH0634)		 4r85 CYTOSINE DEAMINASE
(Klebsiella
pneumoniae) 		5 / 10 HIS A  56
HIS A 241
HIS A 209
THR A 116
ASP A 312
 FE2  A 502 (-3.4A)
FE2  A 502 ( 3.7A)
FE2  A 502 ( 3.4A)
None
17E  A 501 ( 4.4A)
 1.45A 2dttD-4r85A:
undetectable
2dttF-4r85A:
undetectable		 2dttD-4r85A:
14.32
2dttF-4r85A:
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.
2PGF_A_ADNA501_1
(ADENOSINE DEAMINASE)		 4r85 CYTOSINE DEAMINASE
(Klebsiella
pneumoniae) 		6 / 12 HIS A  58
ASP A  60
HIS A 209
GLU A 212
HIS A 241
ASP A 308
 FE2  A 502 ( 3.5A)
None
FE2  A 502 ( 3.4A)
17E  A 501 (-2.9A)
FE2  A 502 ( 3.7A)
FE2  A 502 ( 2.8A)
 0.64A 2pgfA-4r85A:
23.1		 2pgfA-4r85A:
22.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2PGF_A_ADNA501_1
(ADENOSINE DEAMINASE)		 4r85 CYTOSINE DEAMINASE
(Klebsiella
pneumoniae) 		6 / 12 HIS A  58
ASP A 119
HIS A 209
GLU A 212
HIS A 241
ASP A 308
 FE2  A 502 ( 3.5A)
None
FE2  A 502 ( 3.4A)
17E  A 501 (-2.9A)
FE2  A 502 ( 3.7A)
FE2  A 502 ( 2.8A)
 0.92A 2pgfA-4r85A:
23.1		 2pgfA-4r85A:
22.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2PGR_A_DCFA501_1
(ADENOSINE DEAMINASE)		 4r85 CYTOSINE DEAMINASE
(Klebsiella
pneumoniae) 		7 / 12 HIS A  56
HIS A  58
ASP A  60
HIS A 209
GLU A 212
HIS A 241
ASP A 308
 FE2  A 502 (-3.4A)
FE2  A 502 ( 3.5A)
None
FE2  A 502 ( 3.4A)
17E  A 501 (-2.9A)
FE2  A 502 ( 3.7A)
FE2  A 502 ( 2.8A)
 0.64A 2pgrA-4r85A:
23.2		 2pgrA-4r85A:
22.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2PGR_A_DCFA501_1
(ADENOSINE DEAMINASE)		 4r85 CYTOSINE DEAMINASE
(Klebsiella
pneumoniae) 		7 / 12 HIS A  56
HIS A  58
ASP A 119
HIS A 209
GLU A 212
HIS A 241
ASP A 308
 FE2  A 502 (-3.4A)
FE2  A 502 ( 3.5A)
None
FE2  A 502 ( 3.4A)
17E  A 501 (-2.9A)
FE2  A 502 ( 3.7A)
FE2  A 502 ( 2.8A)
 0.89A 2pgrA-4r85A:
23.2		 2pgrA-4r85A:
22.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2VQY_A_PARA1201_1
(AAC(6')-IB)		 4r85 CYTOSINE DEAMINASE
(Klebsiella
pneumoniae) 		5 / 12 GLY A 176
LEU A  76
GLN A 151
SER A 309
ASP A  60
 None
17E  A 501 (-4.9A)
17E  A 501 (-2.9A)
17E  A 501 (-3.2A)
None
 1.28A 2vqyA-4r85A:
0.2		 2vqyA-4r85A:
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.
2VQY_A_PARA1201_1
(AAC(6')-IB)		 4r85 CYTOSINE DEAMINASE
(Klebsiella
pneumoniae) 		5 / 12 GLY A 177
LEU A  76
GLN A 151
SER A 309
ASP A  60
 None
17E  A 501 (-4.9A)
17E  A 501 (-2.9A)
17E  A 501 (-3.2A)
None
 1.43A 2vqyA-4r85A:
0.2		 2vqyA-4r85A:
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.
2X45_B_HSMB1162_1
(ALLERGEN ARG R 1)		 4r85 CYTOSINE DEAMINASE
(Klebsiella
pneumoniae) 		3 / 3 GLU A 273
HIS A 209
GLU A 212
 17E  A 501 (-4.3A)
FE2  A 502 ( 3.4A)
17E  A 501 (-2.9A)
 0.82A 2x45B-4r85A:
undetectable		 2x45B-4r85A:
14.12
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2X45_C_HSMC1162_1
(ALLERGEN ARG R 1)		 4r85 CYTOSINE DEAMINASE
(Klebsiella
pneumoniae) 		3 / 3 GLU A 273
HIS A 209
GLU A 212
 17E  A 501 (-4.3A)
FE2  A 502 ( 3.4A)
17E  A 501 (-2.9A)
 0.81A 2x45C-4r85A:
undetectable		 2x45C-4r85A:
14.12
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4AQL_A_TXCA1452_1
(GUANINE DEAMINASE)		 4r85 CYTOSINE DEAMINASE
(Klebsiella
pneumoniae) 		5 / 12 LEU A  76
HIS A 209
GLU A 212
HIS A 241
ASP A 308
 17E  A 501 (-4.9A)
FE2  A 502 ( 3.4A)
17E  A 501 (-2.9A)
FE2  A 502 ( 3.7A)
FE2  A 502 ( 2.8A)
 0.66A 4aqlA-4r85A:
31.5		 4aqlA-4r85A:
22.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4PQA_A_X8ZA401_1
(SUCCINYL-DIAMINOPIME
LATE DESUCCINYLASE)		 4r85 CYTOSINE DEAMINASE
(Klebsiella
pneumoniae) 		5 / 11 HIS A 241
ASP A 308
GLU A 212
GLY A  79
HIS A  58
 FE2  A 502 ( 3.7A)
FE2  A 502 ( 2.8A)
17E  A 501 (-2.9A)
None
FE2  A 502 ( 3.5A)
 0.91A 4pqaA-4r85A:
undetectable		 4pqaA-4r85A:
20.70
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4QC6_A_KANA201_1
(BIFUNCTIONAL AAC/APH)		 4r85 CYTOSINE DEAMINASE
(Klebsiella
pneumoniae) 		5 / 11 GLY A 176
HIS A 209
TRP A 314
GLN A 151
ASP A 119
 None
FE2  A 502 ( 3.4A)
17E  A 501 (-3.4A)
17E  A 501 (-2.9A)
None
 1.30A 4qc6A-4r85A:
0.0		 4qc6A-4r85A:
16.44
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.
4QC6_B_KANB201_1
(BIFUNCTIONAL AAC/APH)		 4r85 CYTOSINE DEAMINASE
(Klebsiella
pneumoniae) 		5 / 12 GLY A 176
GLU A 212
TRP A 314
GLN A 151
ASP A 119
 None
17E  A 501 (-2.9A)
17E  A 501 (-3.4A)
17E  A 501 (-2.9A)
None
 1.29A 4qc6B-4r85A:
0.8		 4qc6B-4r85A:
16.44
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4R88_A_1LDA501_0
(CYTOSINE DEAMINASE)		 4r85 CYTOSINE DEAMINASE
(Klebsiella
pneumoniae) 		5 / 12 HIS A  58
ILE A  80
GLU A 273
ASP A 308
SER A 309
 FE2  A 502 ( 3.5A)
None
17E  A 501 (-4.3A)
FE2  A 502 ( 2.8A)
17E  A 501 (-3.2A)
 1.45A 4r88A-4r85A:
72.2		 4r88A-4r85A:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4R88_A_1LDA501_0
(CYTOSINE DEAMINASE)		 4r85 CYTOSINE DEAMINASE
(Klebsiella
pneumoniae) 		12 / 12 HIS A  58
LEU A  76
PHE A 149
GLN A 151
ILE A 178
HIS A 209
HIS A 241
GLU A 273
LEU A 277
ASP A 308
SER A 309
TRP A 314
 FE2  A 502 ( 3.5A)
17E  A 501 (-4.9A)
17E  A 501 (-4.9A)
17E  A 501 (-2.9A)
None
FE2  A 502 ( 3.4A)
FE2  A 502 ( 3.7A)
17E  A 501 (-4.3A)
None
FE2  A 502 ( 2.8A)
17E  A 501 (-3.2A)
17E  A 501 (-3.4A)
 0.21A 4r88A-4r85A:
72.2		 4r88A-4r85A:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4R88_A_1LDA501_0
(CYTOSINE DEAMINASE)		 4r85 CYTOSINE DEAMINASE
(Klebsiella
pneumoniae) 		5 / 12 LEU A  76
HIS A 209
ASP A 308
SER A 309
TRP A 314
 17E  A 501 (-4.9A)
FE2  A 502 ( 3.4A)
FE2  A 502 ( 2.8A)
17E  A 501 (-3.2A)
17E  A 501 (-3.4A)
 1.31A 4r88A-4r85A:
72.2		 4r88A-4r85A:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4R88_B_1LDB501_0
(CYTOSINE DEAMINASE)		 4r85 CYTOSINE DEAMINASE
(Klebsiella
pneumoniae) 		12 / 12 HIS A  58
LEU A  76
PHE A 149
GLN A 151
ILE A 178
HIS A 209
GLU A 212
GLU A 273
LEU A 277
ASP A 308
SER A 309
TRP A 314
 FE2  A 502 ( 3.5A)
17E  A 501 (-4.9A)
17E  A 501 (-4.9A)
17E  A 501 (-2.9A)
None
FE2  A 502 ( 3.4A)
17E  A 501 (-2.9A)
17E  A 501 (-4.3A)
None
FE2  A 502 ( 2.8A)
17E  A 501 (-3.2A)
17E  A 501 (-3.4A)
 0.14A 4r88B-4r85A:
72.6		 4r88B-4r85A:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4R88_C_1LDC501_0
(CYTOSINE DEAMINASE)		 4r85 CYTOSINE DEAMINASE
(Klebsiella
pneumoniae) 		12 / 12 HIS A  58
LEU A  76
PHE A 149
GLN A 151
ILE A 178
HIS A 209
GLU A 212
GLU A 273
LEU A 277
ASP A 308
SER A 309
TRP A 314
 FE2  A 502 ( 3.5A)
17E  A 501 (-4.9A)
17E  A 501 (-4.9A)
17E  A 501 (-2.9A)
None
FE2  A 502 ( 3.4A)
17E  A 501 (-2.9A)
17E  A 501 (-4.3A)
None
FE2  A 502 ( 2.8A)
17E  A 501 (-3.2A)
17E  A 501 (-3.4A)
 0.16A 4r88C-4r85A:
72.0		 4r88C-4r85A:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4R88_D_1LDD501_0
(CYTOSINE DEAMINASE)		 4r85 CYTOSINE DEAMINASE
(Klebsiella
pneumoniae) 		12 / 12 HIS A  58
LEU A  76
PHE A 149
GLN A 151
ILE A 178
HIS A 209
GLU A 212
GLU A 273
LEU A 277
ASP A 308
SER A 309
TRP A 314
 FE2  A 502 ( 3.5A)
17E  A 501 (-4.9A)
17E  A 501 (-4.9A)
17E  A 501 (-2.9A)
None
FE2  A 502 ( 3.4A)
17E  A 501 (-2.9A)
17E  A 501 (-4.3A)
None
FE2  A 502 ( 2.8A)
17E  A 501 (-3.2A)
17E  A 501 (-3.4A)
 0.15A 4r88D-4r85A:
71.7		 4r88D-4r85A:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4R88_E_1LDE501_0
(CYTOSINE DEAMINASE)		 4r85 CYTOSINE DEAMINASE
(Klebsiella
pneumoniae) 		12 / 12 HIS A  58
LEU A  76
PHE A 149
GLN A 151
ILE A 178
HIS A 209
GLU A 212
GLU A 273
LEU A 277
ASP A 308
SER A 309
TRP A 314
 FE2  A 502 ( 3.5A)
17E  A 501 (-4.9A)
17E  A 501 (-4.9A)
17E  A 501 (-2.9A)
None
FE2  A 502 ( 3.4A)
17E  A 501 (-2.9A)
17E  A 501 (-4.3A)
None
FE2  A 502 ( 2.8A)
17E  A 501 (-3.2A)
17E  A 501 (-3.4A)
 0.16A 4r88E-4r85A:
72.3		 4r88E-4r85A:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4R88_F_1LDF502_0
(CYTOSINE DEAMINASE)		 4r85 CYTOSINE DEAMINASE
(Klebsiella
pneumoniae) 		12 / 12 HIS A  58
LEU A  76
PHE A 149
GLN A 151
ILE A 178
HIS A 209
GLU A 212
GLU A 273
LEU A 277
ASP A 308
SER A 309
TRP A 314
 FE2  A 502 ( 3.5A)
17E  A 501 (-4.9A)
17E  A 501 (-4.9A)
17E  A 501 (-2.9A)
None
FE2  A 502 ( 3.4A)
17E  A 501 (-2.9A)
17E  A 501 (-4.3A)
None
FE2  A 502 ( 2.8A)
17E  A 501 (-3.2A)
17E  A 501 (-3.4A)
 0.18A 4r88F-4r85A:
71.8		 4r88F-4r85A:
100.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ZRD_B_CUB606_0
(TYROSINASE)		 4r85 CYTOSINE DEAMINASE
(Klebsiella
pneumoniae) 		5 / 5 HIS A  56
HIS A  58
PHE A 149
HIS A 117
HIS A 209
 FE2  A 502 (-3.4A)
FE2  A 502 ( 3.5A)
17E  A 501 (-4.9A)
None
FE2  A 502 ( 3.4A)
 1.35A 5zrdB-4r85A:
undetectable		 5zrdB-4r85A:
24.60
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.
6N91_A_DCFA401_0
(ADENOSINE DEAMINASE)		 4r85 CYTOSINE DEAMINASE
(Klebsiella
pneumoniae) 		7 / 12 HIS A  58
ASP A  60
LEU A  76
HIS A 209
GLU A 212
HIS A 241
ASP A 308
 FE2  A 502 ( 3.5A)
None
17E  A 501 (-4.9A)
FE2  A 502 ( 3.4A)
17E  A 501 (-2.9A)
FE2  A 502 ( 3.7A)
FE2  A 502 ( 2.8A)
 0.68A 6n91A-4r85A:
24.1		 6n91A-4r85A:
13.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6N91_B_DCFB401_0
(ADENOSINE DEAMINASE)		 4r85 CYTOSINE DEAMINASE
(Klebsiella
pneumoniae) 		7 / 12 HIS A  58
ASP A  60
LEU A  76
HIS A 209
GLU A 212
HIS A 241
ASP A 308
 FE2  A 502 ( 3.5A)
None
17E  A 501 (-4.9A)
FE2  A 502 ( 3.4A)
17E  A 501 (-2.9A)
FE2  A 502 ( 3.7A)
FE2  A 502 ( 2.8A)
 0.67A 6n91B-4r85A:
24.1		 6n91B-4r85A:
13.81