SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3g77'

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)		 3g77 CYTOSINE DEAMINASE
(Escherichia
coli) 		7 / 12 HIS A  61
HIS A  63
ASP A  65
HIS A 214
GLU A 217
HIS A 246
ASP A 313
 FE  A 502 (-3.1A)
FE  A 502 (-3.1A)
None
FE  A 502 (-3.6A)
None
FE  A 502 ( 4.8A)
FE  A 502 (-3.2A)
 0.74A 1a4lA-3g77A:
23.0		 1a4lA-3g77A:
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.
1A4L_B_DCFB853_1
(ADENOSINE DEAMINASE)		 3g77 CYTOSINE DEAMINASE
(Escherichia
coli) 		6 / 12 HIS A  63
ASP A  65
HIS A 214
GLU A 217
HIS A 246
ASP A 313
 FE  A 502 (-3.1A)
None
FE  A 502 (-3.6A)
None
FE  A 502 ( 4.8A)
FE  A 502 (-3.2A)
 0.76A 1a4lB-3g77A:
23.0		 1a4lB-3g77A:
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.
1A4L_C_DCFC1353_1
(ADENOSINE DEAMINASE)		 3g77 CYTOSINE DEAMINASE
(Escherichia
coli) 		7 / 12 HIS A  61
HIS A  63
ASP A  65
HIS A 214
GLU A 217
HIS A 246
ASP A 313
 FE  A 502 (-3.1A)
FE  A 502 (-3.1A)
None
FE  A 502 (-3.6A)
None
FE  A 502 ( 4.8A)
FE  A 502 (-3.2A)
 0.69A 1a4lC-3g77A:
23.2		 1a4lC-3g77A:
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.
1A4L_D_DCFD1853_1
(ADENOSINE DEAMINASE)		 3g77 CYTOSINE DEAMINASE
(Escherichia
coli) 		6 / 12 HIS A  63
ASP A  65
HIS A 214
GLU A 217
HIS A 246
ASP A 313
 FE  A 502 (-3.1A)
None
FE  A 502 (-3.6A)
None
FE  A 502 ( 4.8A)
FE  A 502 (-3.2A)
 0.73A 1a4lD-3g77A:
23.0		 1a4lD-3g77A:
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.
1AZM_A_AZMA262_1
(CARBONIC ANHYDRASE I)		 3g77 CYTOSINE DEAMINASE
(Escherichia
coli) 		4 / 8 HIS A  63
HIS A  61
HIS A 122
HIS A 246
 FE  A 502 (-3.1A)
FE  A 502 (-3.1A)
None
FE  A 502 ( 4.8A)
 0.97A 1azmA-3g77A:
undetectable		 1azmA-3g77A:
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.
1BZM_A_MZMA262_1
(CARBONIC ANHYDRASE I)		 3g77 CYTOSINE DEAMINASE
(Escherichia
coli) 		4 / 8 HIS A  63
HIS A  61
HIS A 122
HIS A 246
 FE  A 502 (-3.1A)
FE  A 502 (-3.1A)
None
FE  A 502 ( 4.8A)
 0.85A 1bzmA-3g77A:
undetectable		 1bzmA-3g77A:
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.
1D0V_A_NIOA991_1
(NICOTINATE
MONONUCLEOTIDE:5,6-D
IMETHYLBENZIMIDAZOLE
PHOSPHORIBOSYLTRANSF
ERASE)		 3g77 CYTOSINE DEAMINASE
(Escherichia
coli) 		4 / 8 THR A 200
GLY A 181
GLY A 165
GLY A 158
 None
 0.77A 1d0vA-3g77A:
2.9		 1d0vA-3g77A:
25.06
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1EI6_D_PPFD412_1
(PHOSPHONOACETATE
HYDROLASE)		 3g77 CYTOSINE DEAMINASE
(Escherichia
coli) 		4 / 8 ASP A 313
HIS A  61
HIS A 214
HIS A 246
 FE  A 502 (-3.2A)
FE  A 502 (-3.1A)
FE  A 502 (-3.6A)
FE  A 502 ( 4.8A)
 1.01A 1ei6D-3g77A:
undetectable		 1ei6D-3g77A:
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.
1HK1_A_T44A3003_1
(SERUM ALBUMIN)		 3g77 CYTOSINE DEAMINASE
(Escherichia
coli) 		4 / 6 HIS A 281
ILE A 280
ALA A 274
VAL A 337
 None
 0.90A 1hk1A-3g77A:
undetectable		 1hk1A-3g77A:
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.
1JHA_A_NIOA991_1
(NICOTINATE
MONONUCLEOTIDE:5,6-D
IMETHYLBENZIMIDAZOLE
PHOSPHORIBOSYLTRANSF
ERASE)		 3g77 CYTOSINE DEAMINASE
(Escherichia
coli) 		4 / 8 THR A 200
GLY A 181
GLY A 165
GLY A 158
 None
 0.77A 1jhaA-3g77A:
2.6		 1jhaA-3g77A:
25.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1KW0_A_H4BA429_1
(PHENYLALANINE-4-HYDR
OXYLASE)		 3g77 CYTOSINE DEAMINASE
(Escherichia
coli) 		6 / 12 VAL A 226
LEU A 261
SER A 259
PHE A 262
THR A 247
GLU A 300
 None
 1.50A 1kw0A-3g77A:
undetectable		 1kw0A-3g77A:
21.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1MMK_A_H4BA1427_1
(PHENYLALANINE-4-HYDR
OXYLASE)		 3g77 CYTOSINE DEAMINASE
(Escherichia
coli) 		5 / 12 VAL A 226
LEU A 261
SER A 259
PHE A 262
GLU A 300
 None
 1.20A 1mmkA-3g77A:
undetectable		 1mmkA-3g77A:
21.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1MMT_A_H4BA1426_1
(PHENYLALANINE-4-HYDR
OXYLASE)		 3g77 CYTOSINE DEAMINASE
(Escherichia
coli) 		6 / 11 VAL A 226
LEU A 261
SER A 259
PHE A 262
THR A 247
GLU A 300
 None
 1.47A 1mmtA-3g77A:
undetectable		 1mmtA-3g77A:
21.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1N2X_B_SAMB402_1
(S-ADENOSYL-METHYLTRA
NSFERASE MRAW)		 3g77 CYTOSINE DEAMINASE
(Escherichia
coli) 		4 / 5 VAL A  58
SER A 357
ASP A 365
GLN A 117
 None
 1.43A 1n2xB-3g77A:
2.2		 1n2xB-3g77A:
22.53
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.
1V8B_A_ADNA502_2
(ADENOSYLHOMOCYSTEINA
SE)		 3g77 CYTOSINE DEAMINASE
(Escherichia
coli) 		3 / 3 GLU A  90
GLU A 157
LEU A  81
 None
 0.64A 1v8bA-3g77A:
2.3		 1v8bA-3g77A:
21.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2HS1_B_017B203_1
(HIV-1 PROTEASE)		 3g77 CYTOSINE DEAMINASE
(Escherichia
coli) 		4 / 7 GLU A  49
PRO A 393
ARG A 395
GLY A  51
 None
 1.31A 2hs1B-3g77A:
undetectable		 2hs1B-3g77A:
13.61
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.
2I2Z_A_SALA1100_1
(SERUM ALBUMIN)		 3g77 CYTOSINE DEAMINASE
(Escherichia
coli) 		5 / 5 LEU A  13
LEU A 376
ILE A  22
ILE A  29
ALA A 369
 None
 1.33A 2i2zA-3g77A:
undetectable		 2i2zA-3g77A:
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.
2PGF_A_ADNA501_1
(ADENOSINE DEAMINASE)		 3g77 CYTOSINE DEAMINASE
(Escherichia
coli) 		6 / 12 HIS A  63
ASP A  65
HIS A 214
GLU A 217
HIS A 246
ASP A 313
 FE  A 502 (-3.1A)
None
FE  A 502 (-3.6A)
None
FE  A 502 ( 4.8A)
FE  A 502 (-3.2A)
 0.44A 2pgfA-3g77A:
23.3		 2pgfA-3g77A:
21.54
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.
2PGF_A_ADNA501_1
(ADENOSINE DEAMINASE)		 3g77 CYTOSINE DEAMINASE
(Escherichia
coli) 		6 / 12 HIS A  63
ASP A 124
HIS A 214
GLU A 217
HIS A 246
ASP A 313
 FE  A 502 (-3.1A)
None
FE  A 502 (-3.6A)
None
FE  A 502 ( 4.8A)
FE  A 502 (-3.2A)
 0.86A 2pgfA-3g77A:
23.3		 2pgfA-3g77A:
21.54
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.
2PGR_A_DCFA501_1
(ADENOSINE DEAMINASE)		 3g77 CYTOSINE DEAMINASE
(Escherichia
coli) 		7 / 12 HIS A  61
HIS A  63
ASP A  65
HIS A 214
GLU A 217
HIS A 246
ASP A 313
 FE  A 502 (-3.1A)
FE  A 502 (-3.1A)
None
FE  A 502 (-3.6A)
None
FE  A 502 ( 4.8A)
FE  A 502 (-3.2A)
 0.45A 2pgrA-3g77A:
23.2		 2pgrA-3g77A:
21.54
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.
2PGR_A_DCFA501_1
(ADENOSINE DEAMINASE)		 3g77 CYTOSINE DEAMINASE
(Escherichia
coli) 		7 / 12 HIS A  61
HIS A  63
ASP A 124
HIS A 214
GLU A 217
HIS A 246
ASP A 313
 FE  A 502 (-3.1A)
FE  A 502 (-3.1A)
None
FE  A 502 (-3.6A)
None
FE  A 502 ( 4.8A)
FE  A 502 (-3.2A)
 0.83A 2pgrA-3g77A:
23.2		 2pgrA-3g77A:
21.54
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.
2PGR_A_DCFA501_1
(ADENOSINE DEAMINASE)		 3g77 CYTOSINE DEAMINASE
(Escherichia
coli) 		5 / 12 HIS A 214
HIS A 246
GLY A 311
HIS A  61
HIS A  63
 FE  A 502 (-3.6A)
FE  A 502 ( 4.8A)
None
FE  A 502 (-3.1A)
FE  A 502 (-3.1A)
 1.08A 2pgrA-3g77A:
23.2		 2pgrA-3g77A:
21.54
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.
2X2I_B_QPSB1050_1
(ALPHA-1,4-GLUCAN
LYASE ISOZYME 1)		 3g77 CYTOSINE DEAMINASE
(Escherichia
coli) 		5 / 12 ASP A 313
VAL A 278
PHE A 154
HIS A  63
HIS A 185
 FE  A 502 (-3.2A)
None
None
FE  A 502 (-3.1A)
None
 1.34A 2x2iB-3g77A:
3.5		 2x2iB-3g77A:
17.32
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.
2X2I_D_QPSD1050_1
(ALPHA-1,4-GLUCAN
LYASE ISOZYME 1)		 3g77 CYTOSINE DEAMINASE
(Escherichia
coli) 		5 / 12 ASP A 313
VAL A 278
PHE A 154
HIS A  63
HIS A 185
 FE  A 502 (-3.2A)
None
None
FE  A 502 (-3.1A)
None
 1.36A 2x2iD-3g77A:
4.1		 2x2iD-3g77A:
17.32
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.
3FI0_Q_TRPQ1001_0
(TRYPTOPHANYL-TRNA
SYNTHETASE)		 3g77 CYTOSINE DEAMINASE
(Escherichia
coli) 		4 / 8 GLN A 283
HIS A 246
ASP A 313
VAL A 330
 None
FE  A 502 ( 4.8A)
FE  A 502 (-3.2A)
None
 0.79A 3fi0Q-3g77A:
undetectable		 3fi0Q-3g77A:
21.38
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.
3G9E_A_RO7A1_1
(PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA)		 3g77 CYTOSINE DEAMINASE
(Escherichia
coli) 		5 / 12 GLY A 401
SER A 373
VAL A  53
ILE A   8
HIS A 118
 None
 1.12A 3g9eA-3g77A:
undetectable		 3g9eA-3g77A:
22.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ID6_C_SAMC301_0
(FIBRILLARIN-LIKE
RRNA/TRNA
2'-O-METHYLTRANSFERA
SE)		 3g77 CYTOSINE DEAMINASE
(Escherichia
coli) 		5 / 12 GLY A 181
SER A 196
ALA A 204
ASP A 212
ILE A 211
 None
 1.00A 3id6C-3g77A:
undetectable		 3id6C-3g77A:
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.
3KK6_A_CELA701_2
(PROSTAGLANDIN G/H
SYNTHASE 1)		 3g77 CYTOSINE DEAMINASE
(Escherichia
coli) 		5 / 6 HIS A 246
VAL A 298
LEU A 361
ILE A  62
LEU A 352
 FE  A 502 ( 4.8A)
None
None
None
None
 1.38A 3kk6A-3g77A:
undetectable		 3kk6A-3g77A:
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.
3QPK_A_CUA602_0
(LACCASE-1)		 3g77 CYTOSINE DEAMINASE
(Escherichia
coli) 		3 / 3 HIS A 214
HIS A  61
HIS A  63
 FE  A 502 (-3.6A)
FE  A 502 (-3.1A)
FE  A 502 (-3.1A)
 0.54A 3qpkA-3g77A:
undetectable		 3qpkA-3g77A:
22.38
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.
3QPK_B_CUB602_0
(LACCASE-1)		 3g77 CYTOSINE DEAMINASE
(Escherichia
coli) 		3 / 3 HIS A 214
HIS A  61
HIS A  63
 FE  A 502 (-3.6A)
FE  A 502 (-3.1A)
FE  A 502 (-3.1A)
 0.54A 3qpkB-3g77A:
undetectable		 3qpkB-3g77A:
22.38
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.
3UFN_A_ROCA401_2
(HIV-1 PROTEASE)		 3g77 CYTOSINE DEAMINASE
(Escherichia
coli) 		4 / 7 ASP A 313
GLY A  84
ILE A  85
VAL A 278
 FE  A 502 (-3.2A)
None
None
None
 0.81A 3ufnB-3g77A:
undetectable		 3ufnB-3g77A:
16.09
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.
3W6H_A_AZMA303_1
(CARBONIC ANHYDRASE 1)		 3g77 CYTOSINE DEAMINASE
(Escherichia
coli) 		4 / 8 HIS A  63
HIS A  61
HIS A 122
HIS A 246
 FE  A 502 (-3.1A)
FE  A 502 (-3.1A)
None
FE  A 502 ( 4.8A)
 1.03A 3w6hA-3g77A:
undetectable		 3w6hA-3g77A:
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.
4AQL_A_TXCA1452_1
(GUANINE DEAMINASE)		 3g77 CYTOSINE DEAMINASE
(Escherichia
coli) 		5 / 12 LEU A  81
HIS A 214
GLU A 217
HIS A 246
ASP A 313
 None
FE  A 502 (-3.6A)
None
FE  A 502 ( 4.8A)
FE  A 502 (-3.2A)
 0.63A 4aqlA-3g77A:
31.9		 4aqlA-3g77A:
21.72
Potential target for repurposing, i.e. matched protein structure has less than 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)		 3g77 CYTOSINE DEAMINASE
(Escherichia
coli) 		5 / 10 TYR A 320
HIS A 214
HIS A 246
HIS A  61
ASN A 275
 None
FE  A 502 (-3.6A)
FE  A 502 ( 4.8A)
FE  A 502 (-3.1A)
None
 1.46A 4c1dB-3g77A:
2.2		 4c1dB-3g77A:
22.53
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.
4EF3_A_CUA1002_0
(BLUE COPPER OXIDASE
CUEO)		 3g77 CYTOSINE DEAMINASE
(Escherichia
coli) 		4 / 4 HIS A  61
HIS A  63
HIS A 246
HIS A 214
 FE  A 502 (-3.1A)
FE  A 502 (-3.1A)
FE  A 502 ( 4.8A)
FE  A 502 (-3.6A)
 0.98A 4ef3A-3g77A:
undetectable		 4ef3A-3g77A:
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.
4I41_A_MIXA501_1
(SERINE/THREONINE-PRO
TEIN KINASE PIM-1)		 3g77 CYTOSINE DEAMINASE
(Escherichia
coli) 		5 / 12 ILE A 218
ASP A 216
THR A 228
VAL A 194
GLU A 191
 None
 1.26A 4i41A-3g77A:
undetectable		 4i41A-3g77A:
20.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4IAR_A_ERMA2001_1
(CHIMERA PROTEIN OF
HUMAN
5-HYDROXYTRYPTAMINE
RECEPTOR 1B AND E.
COLI SOLUBLE
CYTOCHROME B562)		 3g77 CYTOSINE DEAMINASE
(Escherichia
coli) 		5 / 12 ASP A 212
ALA A 233
MET A 301
LEU A 352
THR A 360
 None
 1.23A 4iarA-3g77A:
undetectable		 4iarA-3g77A:
22.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4LRH_D_FOLD301_1
(FOLATE RECEPTOR
ALPHA)		 3g77 CYTOSINE DEAMINASE
(Escherichia
coli) 		3 / 3 HIS A 214
TRP A  88
SER A 245
 FE  A 502 (-3.6A)
None
None
 1.23A 4lrhD-3g77A:
undetectable		 4lrhD-3g77A:
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.
4OKB_A_198A1002_1
(ANDROGEN RECEPTOR)		 3g77 CYTOSINE DEAMINASE
(Escherichia
coli) 		5 / 12 LEU A 350
GLY A 349
LEU A 335
VAL A 330
MET A 327
 None
 1.15A 4okbA-3g77A:
undetectable		 4okbA-3g77A:
20.98
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.
4OLT_A_GCSA303_1
(CHITOSANASE)		 3g77 CYTOSINE DEAMINASE
(Escherichia
coli) 		4 / 6 ILE A 280
GLY A 334
VAL A 298
HIS A 251
 None
 1.01A 4oltA-3g77A:
undetectable		 4oltA-3g77A:
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.
4OLT_B_GCSB303_1
(CHITOSANASE)		 3g77 CYTOSINE DEAMINASE
(Escherichia
coli) 		4 / 6 ILE A 280
GLY A 334
VAL A 298
HIS A 251
 None
 1.04A 4oltB-3g77A:
undetectable		 4oltB-3g77A:
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.
4OU1_A_BEZA302_0
(RETRO-ALDOLASE,
DESIGN RA114)		 3g77 CYTOSINE DEAMINASE
(Escherichia
coli) 		4 / 8 ILE A  22
ILE A   8
ALA A  48
TRP A  20
 None
 0.89A 4ou1A-3g77A:
2.4		 4ou1A-3g77A:
21.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4P65_E_IPHE101_0
(INSULIN)		 3g77 CYTOSINE DEAMINASE
(Escherichia
coli) 		5 / 11 ILE A 377
LEU A 350
LEU A  52
ALA A 387
LEU A 328
 None
 0.99A 4p65E-3g77A:
undetectable
4p65F-3g77A:
undetectable
4p65J-3g77A:
undetectable
4p65L-3g77A:
undetectable		 4p65E-3g77A:
4.08
4p65F-3g77A:
5.90
4p65J-3g77A:
5.90
4p65L-3g77A:
5.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4PAE_A_NIZA804_1
(CATALASE-PEROXIDASE)		 3g77 CYTOSINE DEAMINASE
(Escherichia
coli) 		4 / 6 ASP A 313
LEU A 282
HIS A 246
THR A 248
 FE  A 502 (-3.2A)
None
FE  A 502 ( 4.8A)
None
 1.37A 4paeA-3g77A:
undetectable		 4paeA-3g77A:
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.
4PAE_A_NIZA804_1
(CATALASE-PEROXIDASE)		 3g77 CYTOSINE DEAMINASE
(Escherichia
coli) 		4 / 6 ASP A 313
TYR A 320
HIS A 246
THR A 248
 FE  A 502 (-3.2A)
None
FE  A 502 ( 4.8A)
None
 0.97A 4paeA-3g77A:
undetectable		 4paeA-3g77A:
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.
4PQA_A_X8ZA401_1
(SUCCINYL-DIAMINOPIME
LATE DESUCCINYLASE)		 3g77 CYTOSINE DEAMINASE
(Escherichia
coli) 		5 / 11 HIS A 246
ASP A 313
GLU A 217
GLY A  84
HIS A  63
 FE  A 502 ( 4.8A)
FE  A 502 (-3.2A)
None
None
FE  A 502 (-3.1A)
 0.91A 4pqaA-3g77A:
undetectable		 4pqaA-3g77A:
22.53
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.
4QC6_A_KANA201_1
(BIFUNCTIONAL AAC/APH)		 3g77 CYTOSINE DEAMINASE
(Escherichia
coli) 		5 / 11 GLY A 181
GLU A 217
TRP A 319
GLN A 156
ASP A 124
 None
 1.41A 4qc6A-3g77A:
0.0		 4qc6A-3g77A:
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.
4QC6_B_KANB201_1
(BIFUNCTIONAL AAC/APH)		 3g77 CYTOSINE DEAMINASE
(Escherichia
coli) 		5 / 12 GLY A 181
GLU A 217
TRP A 319
GLN A 156
ASP A 124
 None
 1.33A 4qc6B-3g77A:
0.0		 4qc6B-3g77A:
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.
4R29_D_SAMD301_1
(UNCHARACTERIZED
PROTEIN)		 3g77 CYTOSINE DEAMINASE
(Escherichia
coli) 		3 / 3 ARG A 174
GLU A 166
TYR A 207
 None
 0.92A 4r29D-3g77A:
undetectable		 4r29D-3g77A:
18.41
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)		 3g77 CYTOSINE DEAMINASE
(Escherichia
coli) 		10 / 12 HIS A  63
LEU A  81
PHE A 154
GLN A 156
ILE A 183
HIS A 214
HIS A 246
LEU A 282
ASP A 313
TRP A 319
 FE  A 502 (-3.1A)
None
None
None
None
FE  A 502 (-3.6A)
FE  A 502 ( 4.8A)
None
FE  A 502 (-3.2A)
None
 0.34A 4r88A-3g77A:
67.2		 4r88A-3g77A:
54.97
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)		 3g77 CYTOSINE DEAMINASE
(Escherichia
coli) 		10 / 12 HIS A  63
LEU A  81
PHE A 154
GLN A 156
ILE A 183
HIS A 214
GLU A 217
LEU A 282
ASP A 313
TRP A 319
 FE  A 502 (-3.1A)
None
None
None
None
FE  A 502 (-3.6A)
None
None
FE  A 502 (-3.2A)
None
 0.32A 4r88B-3g77A:
68.7		 4r88B-3g77A:
54.97
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)		 3g77 CYTOSINE DEAMINASE
(Escherichia
coli) 		10 / 12 HIS A  63
LEU A  81
PHE A 154
GLN A 156
ILE A 183
HIS A 214
GLU A 217
LEU A 282
ASP A 313
TRP A 319
 FE  A 502 (-3.1A)
None
None
None
None
FE  A 502 (-3.6A)
None
None
FE  A 502 (-3.2A)
None
 0.32A 4r88C-3g77A:
67.5		 4r88C-3g77A:
54.97
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)		 3g77 CYTOSINE DEAMINASE
(Escherichia
coli) 		10 / 12 HIS A  63
LEU A  81
PHE A 154
GLN A 156
ILE A 183
HIS A 214
GLU A 217
LEU A 282
ASP A 313
TRP A 319
 FE  A 502 (-3.1A)
None
None
None
None
FE  A 502 (-3.6A)
None
None
FE  A 502 (-3.2A)
None
 0.37A 4r88D-3g77A:
67.3		 4r88D-3g77A:
54.97
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)		 3g77 CYTOSINE DEAMINASE
(Escherichia
coli) 		10 / 12 HIS A  63
LEU A  81
PHE A 154
GLN A 156
ILE A 183
HIS A 214
GLU A 217
LEU A 282
ASP A 313
TRP A 319
 FE  A 502 (-3.1A)
None
None
None
None
FE  A 502 (-3.6A)
None
None
FE  A 502 (-3.2A)
None
 0.33A 4r88E-3g77A:
67.5		 4r88E-3g77A:
54.97
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)		 3g77 CYTOSINE DEAMINASE
(Escherichia
coli) 		10 / 12 HIS A  63
LEU A  81
PHE A 154
GLN A 156
ILE A 183
HIS A 214
GLU A 217
LEU A 282
ASP A 313
TRP A 319
 FE  A 502 (-3.1A)
None
None
None
None
FE  A 502 (-3.6A)
None
None
FE  A 502 (-3.2A)
None
 0.34A 4r88F-3g77A:
67.5		 4r88F-3g77A:
54.97
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.
4TWD_F_377F401_1
(CYS-LOOP
LIGAND-GATED ION
CHANNEL)		 3g77 CYTOSINE DEAMINASE
(Escherichia
coli) 		4 / 7 GLU A 382
TYR A 343
PHE A 385
ARG A 426
 None
 0.81A 4twdF-3g77A:
undetectable
4twdJ-3g77A:
undetectable		 4twdF-3g77A:
21.80
4twdJ-3g77A:
21.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5H1E_A_VDXA501_1
(VITAMIN D3 RECEPTOR)		 3g77 CYTOSINE DEAMINASE
(Escherichia
coli) 		5 / 12 PHE A 286
ILE A  85
SER A  78
VAL A 278
HIS A  63
 None
None
None
None
FE  A 502 (-3.1A)
 1.17A 5h1eA-3g77A:
undetectable		 5h1eA-3g77A:
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.
5KR2_A_ROCA101_2
(PROTEASE PR5-SQV)		 3g77 CYTOSINE DEAMINASE
(Escherichia
coli) 		5 / 11 LEU A  46
ALA A  11
ILE A  32
ILE A  54
ILE A   8
 None
 1.24A 5kr2B-3g77A:
undetectable		 5kr2B-3g77A:
15.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5MIG_A_CUA601_0
(LACCASE 2)		 3g77 CYTOSINE DEAMINASE
(Escherichia
coli) 		3 / 3 HIS A 214
HIS A  61
HIS A  63
 FE  A 502 (-3.6A)
FE  A 502 (-3.1A)
FE  A 502 (-3.1A)
 0.49A 5migA-3g77A:
undetectable		 5migA-3g77A:
21.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5SYJ_A_NIZA810_1
(CATALASE-PEROXIDASE)		 3g77 CYTOSINE DEAMINASE
(Escherichia
coli) 		4 / 6 ARG A 190
LEU A 197
PRO A 184
SER A 223
 None
 1.25A 5syjA-3g77A:
undetectable		 5syjA-3g77A:
20.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5SYJ_B_NIZB810_1
(CATALASE-PEROXIDASE)		 3g77 CYTOSINE DEAMINASE
(Escherichia
coli) 		4 / 6 ARG A 190
LEU A 197
PRO A 184
SER A 223
 None
 1.27A 5syjB-3g77A:
undetectable		 5syjB-3g77A:
20.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5TE8_C_08JC602_1
(CYTOCHROME P450 3A4)		 3g77 CYTOSINE DEAMINASE
(Escherichia
coli) 		4 / 7 LEU A 130
ALA A 172
ILE A 151
LEU A 137
 None
 0.93A 5te8C-3g77A:
undetectable		 5te8C-3g77A:
21.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5UC3_A_486A801_2
(GLUCOCORTICOID
RECEPTOR)		 3g77 CYTOSINE DEAMINASE
(Escherichia
coli) 		4 / 5 LEU A 331
LEU A 352
MET A 341
GLN A 391
 None
 1.31A 5uc3A-3g77A:
undetectable		 5uc3A-3g77A:
11.35
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.
5ZRD_B_CUB606_0
(TYROSINASE)		 3g77 CYTOSINE DEAMINASE
(Escherichia
coli) 		5 / 5 HIS A  61
HIS A  63
PHE A 154
HIS A 122
HIS A 214
 FE  A 502 (-3.1A)
FE  A 502 (-3.1A)
None
None
FE  A 502 (-3.6A)
 1.17A 5zrdB-3g77A:
undetectable		 5zrdB-3g77A:
22.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ZRD_C_CUC604_0
(TYROSINASE)		 3g77 CYTOSINE DEAMINASE
(Escherichia
coli) 		4 / 4 HIS A  61
HIS A  63
HIS A 122
HIS A 214
 FE  A 502 (-3.1A)
FE  A 502 (-3.1A)
None
FE  A 502 (-3.6A)
 1.03A 5zrdC-3g77A:
undetectable		 5zrdC-3g77A:
22.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ZRD_D_CUD607_0
(TYROSINASE)		 3g77 CYTOSINE DEAMINASE
(Escherichia
coli) 		4 / 4 HIS A  61
HIS A  63
HIS A 122
HIS A 214
 FE  A 502 (-3.1A)
FE  A 502 (-3.1A)
None
FE  A 502 (-3.6A)
 0.99A 5zrdD-3g77A:
undetectable		 5zrdD-3g77A:
22.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6N91_A_DCFA401_0
(ADENOSINE DEAMINASE)		 3g77 CYTOSINE DEAMINASE
(Escherichia
coli) 		7 / 12 HIS A  63
ASP A  65
LEU A  81
HIS A 214
GLU A 217
HIS A 246
ASP A 313
 FE  A 502 (-3.1A)
None
None
FE  A 502 (-3.6A)
None
FE  A 502 ( 4.8A)
FE  A 502 (-3.2A)
 0.53A 6n91A-3g77A:
24.3		 6n91A-3g77A:
11.44
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.
6N91_B_DCFB401_0
(ADENOSINE DEAMINASE)		 3g77 CYTOSINE DEAMINASE
(Escherichia
coli) 		7 / 12 HIS A  63
ASP A  65
LEU A  81
HIS A 214
GLU A 217
HIS A 246
ASP A 313
 FE  A 502 (-3.1A)
None
None
FE  A 502 (-3.6A)
None
FE  A 502 ( 4.8A)
FE  A 502 (-3.2A)
 0.55A 6n91B-3g77A:
24.4		 6n91B-3g77A:
11.44