SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '1o12'

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.
1E9Y_B_HAEB800_1
(UREASE SUBUNIT BETA)		 1o12 N-ACETYLGLUCOSAMINE-
6-PHOSPHATE
DEACETYLASE
(Thermotoga
maritima) 		5 / 5 HIS A  49
HIS A 127
HIS A 176
HIS A 197
ASP A 255
 None
FE  A 401 ( 4.8A)
FE  A 401 (-3.3A)
FE  A 401 (-3.5A)
None
 1.08A 1e9yB-1o12A:
18.7		 1e9yB-1o12A:
21.63
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.
1FWE_C_HAEC989_1
(UREASE)		 1o12 N-ACETYLGLUCOSAMINE-
6-PHOSPHATE
DEACETYLASE
(Thermotoga
maritima) 		6 / 6 HIS A  49
HIS A  51
HIS A 127
HIS A 176
HIS A 197
ASP A 255
 None
None
FE  A 401 ( 4.8A)
FE  A 401 (-3.3A)
FE  A 401 (-3.5A)
None
 1.04A 1fweC-1o12A:
19.1		 1fweC-1o12A:
21.89
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.
1GM7_B_PNNB1577_0
(PENICILLIN G ACYLASE
ALPHA SUBUNIT
PENICILLIN G ACYLASE
BETA SUBUNIT)		 1o12 N-ACETYLGLUCOSAMINE-
6-PHOSPHATE
DEACETYLASE
(Thermotoga
maritima) 		4 / 8 SER A 177
ALA A 174
PHE A 152
ILE A 195
 None
 1.16A 1gm7A-1o12A:
0.0
1gm7B-1o12A:
undetectable		 1gm7A-1o12A:
19.53
1gm7B-1o12A:
21.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ITU_A_CILA451_1
(RENAL DIPEPTIDASE)		 1o12 N-ACETYLGLUCOSAMINE-
6-PHOSPHATE
DEACETYLASE
(Thermotoga
maritima) 		5 / 12 GLU A 115
HIS A 127
HIS A 176
HIS A 197
ASP A 255
 FE  A 401 (-2.6A)
FE  A 401 ( 4.8A)
FE  A 401 (-3.3A)
FE  A 401 (-3.5A)
None
 1.29A 1ituA-1o12A:
14.7		 1ituA-1o12A:
22.46
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.
1ITU_B_CILB452_1
(RENAL DIPEPTIDASE)		 1o12 N-ACETYLGLUCOSAMINE-
6-PHOSPHATE
DEACETYLASE
(Thermotoga
maritima) 		5 / 12 GLU A 115
HIS A 127
HIS A 176
HIS A 197
ASP A 255
 FE  A 401 (-2.6A)
FE  A 401 ( 4.8A)
FE  A 401 (-3.3A)
FE  A 401 (-3.5A)
None
 1.33A 1ituB-1o12A:
14.7		 1ituB-1o12A:
22.46
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.
1QU2_A_MRCA1993_1
(ISOLEUCYL-TRNA
SYNTHETASE)		 1o12 N-ACETYLGLUCOSAMINE-
6-PHOSPHATE
DEACETYLASE
(Thermotoga
maritima) 		5 / 12 HIS A 176
GLY A 125
HIS A 127
GLY A 290
ASP A 255
 FE  A 401 (-3.3A)
None
FE  A 401 ( 4.8A)
None
None
 0.99A 1qu2A-1o12A:
undetectable		 1qu2A-1o12A:
18.59
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.
1V7Z_A_CRNA401_1
(CREATININE
AMIDOHYDROLASE)		 1o12 N-ACETYLGLUCOSAMINE-
6-PHOSPHATE
DEACETYLASE
(Thermotoga
maritima) 		4 / 8 GLU A 115
HIS A  51
ASP A 255
HIS A 197
 FE  A 401 (-2.6A)
None
None
FE  A 401 (-3.5A)
 0.90A 1v7zA-1o12A:
undetectable		 1v7zA-1o12A:
25.38
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.
1V7Z_B_CRNB3401_1
(CREATININE
AMIDOHYDROLASE)		 1o12 N-ACETYLGLUCOSAMINE-
6-PHOSPHATE
DEACETYLASE
(Thermotoga
maritima) 		4 / 8 GLU A 115
HIS A  51
ASP A 255
HIS A 197
 FE  A 401 (-2.6A)
None
None
FE  A 401 (-3.5A)
 0.89A 1v7zB-1o12A:
undetectable		 1v7zB-1o12A:
25.38
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.
1V7Z_C_CRNC4401_1
(CREATININE
AMIDOHYDROLASE)		 1o12 N-ACETYLGLUCOSAMINE-
6-PHOSPHATE
DEACETYLASE
(Thermotoga
maritima) 		4 / 8 GLU A 115
HIS A  51
ASP A 255
HIS A 197
 FE  A 401 (-2.6A)
None
None
FE  A 401 (-3.5A)
 0.89A 1v7zC-1o12A:
undetectable		 1v7zC-1o12A:
25.38
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.
1V7Z_D_CRND5401_1
(CREATININE
AMIDOHYDROLASE)		 1o12 N-ACETYLGLUCOSAMINE-
6-PHOSPHATE
DEACETYLASE
(Thermotoga
maritima) 		4 / 8 GLU A 115
HIS A  51
ASP A 255
HIS A 197
 FE  A 401 (-2.6A)
None
None
FE  A 401 (-3.5A)
 0.91A 1v7zD-1o12A:
undetectable		 1v7zD-1o12A:
25.38
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.
1V7Z_E_CRNE6401_1
(CREATININE
AMIDOHYDROLASE)		 1o12 N-ACETYLGLUCOSAMINE-
6-PHOSPHATE
DEACETYLASE
(Thermotoga
maritima) 		4 / 8 GLU A 115
HIS A  51
ASP A 255
HIS A 197
 FE  A 401 (-2.6A)
None
None
FE  A 401 (-3.5A)
 0.91A 1v7zE-1o12A:
undetectable		 1v7zE-1o12A:
25.38
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.
1V7Z_F_CRNF7401_1
(CREATININE
AMIDOHYDROLASE)		 1o12 N-ACETYLGLUCOSAMINE-
6-PHOSPHATE
DEACETYLASE
(Thermotoga
maritima) 		4 / 8 GLU A 115
HIS A  51
ASP A 255
HIS A 197
 FE  A 401 (-2.6A)
None
None
FE  A 401 (-3.5A)
 0.89A 1v7zF-1o12A:
undetectable		 1v7zF-1o12A:
25.38
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.
1V8B_A_ADNA502_2
(ADENOSYLHOMOCYSTEINA
SE)		 1o12 N-ACETYLGLUCOSAMINE-
6-PHOSPHATE
DEACETYLASE
(Thermotoga
maritima) 		3 / 3 GLU A 155
GLU A 160
LEU A 172
 None
 0.65A 1v8bA-1o12A:
undetectable		 1v8bA-1o12A:
23.43
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.
1V8B_B_ADNB1502_2
(ADENOSYLHOMOCYSTEINA
SE)		 1o12 N-ACETYLGLUCOSAMINE-
6-PHOSPHATE
DEACETYLASE
(Thermotoga
maritima) 		3 / 3 GLU A 155
GLU A 160
LEU A 172
 None
 0.64A 1v8bB-1o12A:
undetectable		 1v8bB-1o12A:
23.43
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.
2X1L_C_ADNC601_1
(METHIONYL-TRNA
SYNTHETASE)		 1o12 N-ACETYLGLUCOSAMINE-
6-PHOSPHATE
DEACETYLASE
(Thermotoga
maritima) 		5 / 11 HIS A 176
GLY A 125
HIS A 127
GLY A 290
ASP A 255
 FE  A 401 (-3.3A)
None
FE  A 401 ( 4.8A)
None
None
 1.07A 2x1lC-1o12A:
undetectable		 2x1lC-1o12A:
22.04
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.
2XXG_C_CUC1339_0
(DISSIMILATORY
COPPER-CONTAINING
NITRITE REDUCTASE)		 1o12 N-ACETYLGLUCOSAMINE-
6-PHOSPHATE
DEACETYLASE
(Thermotoga
maritima) 		3 / 3 ASP A 255
HIS A 197
HIS A  49
 None
FE  A 401 (-3.5A)
None
 0.71A 2xxgC-1o12A:
undetectable		 2xxgC-1o12A:
23.13
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.
2Y7W_B_SALB1300_1
(LYSR-TYPE REGULATORY
PROTEIN)		 1o12 N-ACETYLGLUCOSAMINE-
6-PHOSPHATE
DEACETYLASE
(Thermotoga
maritima) 		5 / 10 THR A 151
GLY A 116
HIS A  51
THR A 196
HIS A 197
 None
None
None
None
FE  A 401 (-3.5A)
 1.18A 2y7wB-1o12A:
undetectable		 2y7wB-1o12A:
19.58
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.
3A6J_A_CRNA303_1
(CREATININE
AMIDOHYDROLASE)		 1o12 N-ACETYLGLUCOSAMINE-
6-PHOSPHATE
DEACETYLASE
(Thermotoga
maritima) 		4 / 8 GLU A 115
HIS A  51
ASP A 255
HIS A 197
 FE  A 401 (-2.6A)
None
None
FE  A 401 (-3.5A)
 0.88A 3a6jA-1o12A:
undetectable		 3a6jA-1o12A:
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.
3A6J_B_CRNB304_1
(CREATININE
AMIDOHYDROLASE)		 1o12 N-ACETYLGLUCOSAMINE-
6-PHOSPHATE
DEACETYLASE
(Thermotoga
maritima) 		4 / 7 GLU A 115
HIS A  51
ASP A 255
HIS A 197
 FE  A 401 (-2.6A)
None
None
FE  A 401 (-3.5A)
 0.85A 3a6jB-1o12A:
undetectable		 3a6jB-1o12A:
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.
3A6J_C_CRNC305_1
(CREATININE
AMIDOHYDROLASE)		 1o12 N-ACETYLGLUCOSAMINE-
6-PHOSPHATE
DEACETYLASE
(Thermotoga
maritima) 		4 / 8 GLU A 115
HIS A  51
ASP A 255
HIS A 197
 FE  A 401 (-2.6A)
None
None
FE  A 401 (-3.5A)
 0.86A 3a6jC-1o12A:
undetectable		 3a6jC-1o12A:
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.
3A6J_E_CRNE306_1
(CREATININE
AMIDOHYDROLASE)		 1o12 N-ACETYLGLUCOSAMINE-
6-PHOSPHATE
DEACETYLASE
(Thermotoga
maritima) 		4 / 8 GLU A 115
HIS A  51
ASP A 255
HIS A 197
 FE  A 401 (-2.6A)
None
None
FE  A 401 (-3.5A)
 0.88A 3a6jE-1o12A:
undetectable		 3a6jE-1o12A:
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.
3A6J_F_CRNF307_1
(CREATININE
AMIDOHYDROLASE)		 1o12 N-ACETYLGLUCOSAMINE-
6-PHOSPHATE
DEACETYLASE
(Thermotoga
maritima) 		4 / 8 GLU A 115
HIS A  51
ASP A 255
HIS A 197
 FE  A 401 (-2.6A)
None
None
FE  A 401 (-3.5A)
 0.85A 3a6jF-1o12A:
undetectable		 3a6jF-1o12A:
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.
3APT_B_ACTB311_0
(METHYLENETETRAHYDROF
OLATE REDUCTASE)		 1o12 N-ACETYLGLUCOSAMINE-
6-PHOSPHATE
DEACETYLASE
(Thermotoga
maritima) 		5 / 9 GLU A 115
HIS A  51
ASP A 255
ALA A 289
HIS A 127
 FE  A 401 (-2.6A)
None
None
None
FE  A 401 ( 4.8A)
 1.09A 3aptB-1o12A:
6.3		 3aptB-1o12A:
22.28
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.
3GWX_A_EPAA1_2
(PROTEIN (PEROXISOME
PROLIFERATOR
ACTIVATED RECEPTOR
(PPAR-DELTA)))		 1o12 N-ACETYLGLUCOSAMINE-
6-PHOSPHATE
DEACETYLASE
(Thermotoga
maritima) 		5 / 12 THR A  81
THR A  82
THR A  58
ILE A 143
ILE A 170
 None
 1.19A 3gwxA-1o12A:
undetectable		 3gwxA-1o12A:
19.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3HCN_B_CHDB2_0
(FERROCHELATASE,
MITOCHONDRIAL)		 1o12 N-ACETYLGLUCOSAMINE-
6-PHOSPHATE
DEACETYLASE
(Thermotoga
maritima) 		3 / 3 LEU A 114
LEU A 150
ARG A 168
 None
 0.64A 3hcnB-1o12A:
undetectable		 3hcnB-1o12A:
21.30
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3LSF_B_PZIB802_0
(GLUTAMATE RECEPTOR 2)		 1o12 N-ACETYLGLUCOSAMINE-
6-PHOSPHATE
DEACETYLASE
(Thermotoga
maritima) 		3 / 3 SER A 291
ASP A 229
ASN A 301
 None
 0.92A 3lsfB-1o12A:
0.0
3lsfE-1o12A:
undetectable		 3lsfB-1o12A:
22.79
3lsfE-1o12A:
22.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3LSF_E_PZIE802_0
(GLUTAMATE RECEPTOR 2)		 1o12 N-ACETYLGLUCOSAMINE-
6-PHOSPHATE
DEACETYLASE
(Thermotoga
maritima) 		3 / 3 ASP A 229
ASN A 301
SER A 291
 None
 0.92A 3lsfB-1o12A:
0.0
3lsfE-1o12A:
undetectable		 3lsfB-1o12A:
22.79
3lsfE-1o12A:
22.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3MJR_D_AC2D601_1
(DEOXYCYTIDINE KINASE)		 1o12 N-ACETYLGLUCOSAMINE-
6-PHOSPHATE
DEACETYLASE
(Thermotoga
maritima) 		4 / 8 PHE A  63
ARG A  98
ARG A  95
ASP A  99
 None
 1.17A 3mjrD-1o12A:
undetectable		 3mjrD-1o12A:
22.34
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.
3OGQ_A_AB1A200_1
(FIV PROTEASE)		 1o12 N-ACETYLGLUCOSAMINE-
6-PHOSPHATE
DEACETYLASE
(Thermotoga
maritima) 		5 / 10 LEU A 165
VAL A 192
GLY A 175
ILE A 119
LEU A 172
 None
 0.94A 3ogqA-1o12A:
undetectable		 3ogqA-1o12A:
16.21
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.
4A7B_B_HAEB1270_1
(COLLAGENASE 3)		 1o12 N-ACETYLGLUCOSAMINE-
6-PHOSPHATE
DEACETYLASE
(Thermotoga
maritima) 		4 / 5 LEU A 269
HIS A 197
GLU A 115
HIS A 176
 None
FE  A 401 (-3.5A)
FE  A 401 (-2.6A)
FE  A 401 (-3.3A)
 1.15A 4a7bB-1o12A:
undetectable		 4a7bB-1o12A:
17.55
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4A97_D_ZPCD1318_1
(CYS-LOOP
LIGAND-GATED ION
CHANNEL)		 1o12 N-ACETYLGLUCOSAMINE-
6-PHOSPHATE
DEACETYLASE
(Thermotoga
maritima) 		4 / 8 TYR A 319
VAL A 316
ILE A 250
ASN A 320
 None
 1.03A 4a97C-1o12A:
0.0		 4a97C-1o12A:
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.
4H9M_A_HAEA929_1
(UREASE)		 1o12 N-ACETYLGLUCOSAMINE-
6-PHOSPHATE
DEACETYLASE
(Thermotoga
maritima) 		5 / 5 HIS A  49
HIS A 127
HIS A 176
HIS A 197
ASP A 255
 None
FE  A 401 ( 4.8A)
FE  A 401 (-3.3A)
FE  A 401 (-3.5A)
None
 1.12A 4h9mA-1o12A:
5.3		 4h9mA-1o12A:
19.74
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.
4HVR_A_SALA203_1
(3-HYDROXYANTHRANILAT
E 3,4-DIOXYGENASE)		 1o12 N-ACETYLGLUCOSAMINE-
6-PHOSPHATE
DEACETYLASE
(Thermotoga
maritima) 		4 / 7 HIS A 197
GLU A 115
HIS A  49
VAL A  83
 FE  A 401 (-3.5A)
FE  A 401 (-2.6A)
None
None
 0.96A 4hvrA-1o12A:
undetectable		 4hvrA-1o12A:
19.31
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.
4LB2_A_DM5A601_1
(SERUM ALBUMIN)		 1o12 N-ACETYLGLUCOSAMINE-
6-PHOSPHATE
DEACETYLASE
(Thermotoga
maritima) 		4 / 7 LEU A 163
PRO A 154
LYS A 189
GLU A 190
 None
 1.05A 4lb2A-1o12A:
undetectable		 4lb2A-1o12A:
20.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4NKV_A_AERA601_2
(STEROID
17-ALPHA-HYDROXYLASE
/17,20 LYASE)		 1o12 N-ACETYLGLUCOSAMINE-
6-PHOSPHATE
DEACETYLASE
(Thermotoga
maritima) 		4 / 5 LEU A 110
ASP A 328
GLU A 324
VAL A 166
 None
 1.28A 4nkvA-1o12A:
undetectable		 4nkvA-1o12A:
21.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4R7L_A_SHHA709_1
(LEUKOTRIENE A-4
HYDROLASE)		 1o12 N-ACETYLGLUCOSAMINE-
6-PHOSPHATE
DEACETYLASE
(Thermotoga
maritima) 		5 / 12 ALA A 153
HIS A  49
GLU A 225
HIS A 197
GLU A 115
 None
None
None
FE  A 401 (-3.5A)
FE  A 401 (-2.6A)
 1.15A 4r7lA-1o12A:
undetectable		 4r7lA-1o12A:
20.76
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.
4UBP_C_HAEC800_1
(PROTEIN (UREASE
(CHAIN C)))		 1o12 N-ACETYLGLUCOSAMINE-
6-PHOSPHATE
DEACETYLASE
(Thermotoga
maritima) 		6 / 6 HIS A  49
HIS A  51
HIS A 127
HIS A 176
HIS A 197
ASP A 255
 None
None
FE  A 401 ( 4.8A)
FE  A 401 (-3.3A)
FE  A 401 (-3.5A)
None
 1.03A 4ubpC-1o12A:
18.7		 4ubpC-1o12A:
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.
5D4N_C_ACTC201_0
(NITROGEN REGULATORY
PROTEIN P-II)		 1o12 N-ACETYLGLUCOSAMINE-
6-PHOSPHATE
DEACETYLASE
(Thermotoga
maritima) 		4 / 5 VAL A 222
VAL A 192
GLY A 191
PHE A 184
 None
 0.88A 5d4nA-1o12A:
undetectable
5d4nC-1o12A:
undetectable		 5d4nA-1o12A:
15.73
5d4nC-1o12A:
15.73
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.
5I73_A_68PA705_1
(SODIUM-DEPENDENT
SEROTONIN
TRANSPORTER)		 1o12 N-ACETYLGLUCOSAMINE-
6-PHOSPHATE
DEACETYLASE
(Thermotoga
maritima) 		5 / 9 ARG A 194
ALA A 174
PRO A 199
LEU A 202
ILE A 212
 None
 1.34A 5i73A-1o12A:
0.0		 5i73A-1o12A:
21.47
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.
5OGJ_A_ACTA307_0
(CARBONIC ANHYDRASE
13)		 1o12 N-ACETYLGLUCOSAMINE-
6-PHOSPHATE
DEACETYLASE
(Thermotoga
maritima) 		4 / 6 HIS A 113
HIS A  49
VAL A 253
THR A 196
 None
 1.06A 5ogjA-1o12A:
undetectable		 5ogjA-1o12A:
22.54
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.
5OGJ_B_ACTB305_0
(CARBONIC ANHYDRASE
13)		 1o12 N-ACETYLGLUCOSAMINE-
6-PHOSPHATE
DEACETYLASE
(Thermotoga
maritima) 		4 / 6 HIS A 113
HIS A  49
VAL A 253
THR A 196
 None
 1.05A 5ogjB-1o12A:
undetectable		 5ogjB-1o12A:
22.54
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.
5OHH_A_ACTA307_0
(CARBONIC ANHYDRASE
13)		 1o12 N-ACETYLGLUCOSAMINE-
6-PHOSPHATE
DEACETYLASE
(Thermotoga
maritima) 		4 / 5 HIS A 113
HIS A  49
VAL A 253
THR A 196
 None
 1.07A 5ohhA-1o12A:
undetectable		 5ohhA-1o12A:
22.54
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.
5OHH_B_ACTB311_0
(CARBONIC ANHYDRASE
13)		 1o12 N-ACETYLGLUCOSAMINE-
6-PHOSPHATE
DEACETYLASE
(Thermotoga
maritima) 		4 / 6 HIS A 113
HIS A  49
VAL A 253
THR A 196
 None
 1.07A 5ohhB-1o12A:
undetectable		 5ohhB-1o12A:
22.54
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.
5W97_C_CHDC306_0
(CYTOCHROME C OXIDASE
SUBUNIT 3
CYTOCHROME C OXIDASE
SUBUNIT 7A1,
MITOCHONDRIAL)		 1o12 N-ACETYLGLUCOSAMINE-
6-PHOSPHATE
DEACETYLASE
(Thermotoga
maritima) 		4 / 6 ARG A 168
LEU A 165
PHE A 152
LEU A 140
 None
 1.01A 5w97C-1o12A:
0.0
5w97J-1o12A:
0.0		 5w97C-1o12A:
22.61
5w97J-1o12A:
10.32
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.
6EMU_B_SAMB301_0
(TRNA
(GUANINE(9)-/ADENINE
(9)-N1)-METHYLTRANSF
ERASE)		 1o12 N-ACETYLGLUCOSAMINE-
6-PHOSPHATE
DEACETYLASE
(Thermotoga
maritima) 		5 / 12 ILE A 210
GLY A 211
ILE A 212
VAL A 241
VAL A 244
 None
 0.96A 6emuB-1o12A:
undetectable		 6emuB-1o12A:
21.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6EMU_C_SAMC301_0
(TRNA
(GUANINE(9)-/ADENINE
(9)-N1)-METHYLTRANSF
ERASE)		 1o12 N-ACETYLGLUCOSAMINE-
6-PHOSPHATE
DEACETYLASE
(Thermotoga
maritima) 		5 / 12 ILE A 210
GLY A 211
ILE A 212
VAL A 241
VAL A 244
 None
 0.91A 6emuC-1o12A:
undetectable		 6emuC-1o12A:
21.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6N91_A_DCFA401_0
(ADENOSINE DEAMINASE)		 1o12 N-ACETYLGLUCOSAMINE-
6-PHOSPHATE
DEACETYLASE
(Thermotoga
maritima) 		5 / 12 HIS A 197
SER A 173
HIS A 176
HIS A 127
ASP A 255
 FE  A 401 (-3.5A)
None
FE  A 401 (-3.3A)
FE  A 401 ( 4.8A)
None
 1.25A 6n91A-1o12A:
13.7		 6n91A-1o12A:
11.70
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.
6N91_B_DCFB401_0
(ADENOSINE DEAMINASE)		 1o12 N-ACETYLGLUCOSAMINE-
6-PHOSPHATE
DEACETYLASE
(Thermotoga
maritima) 		5 / 12 HIS A 197
SER A 173
HIS A 176
HIS A 127
ASP A 255
 FE  A 401 (-3.5A)
None
FE  A 401 (-3.3A)
FE  A 401 ( 4.8A)
None
 1.25A 6n91B-1o12A:
13.8		 6n91B-1o12A:
11.70