SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '5IP'


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.
1JR1_A_MOAA1332_1
(INOSINE-5'-MONOPHOSP
HATE DEHYDROGENASE 2)
3moz MYO-INOSITOL
HEXAPHOSPHATE
PHOSPHOHYDROLASE

(Selenomonas
ruminantium)
5 / 11 SER A 106
ASN A  69
ARG A  68
GLY A 288
THR A 260
GOL  A1007 ( 3.9A)
None
5IP  A 401 (-3.9A)
None
None
1.19A 1jr1A-3mozA:
undetectable
1jr1A-3mozA:
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.
1XWF_A_ADNA433_2
(ADENOSYLHOMOCYSTEINA
SE)
3moz MYO-INOSITOL
HEXAPHOSPHATE
PHOSPHOHYDROLASE

(Selenomonas
ruminantium)
3 / 3 THR A 259
GLU A 136
HIS A 224
PO4  A 400 (-3.8A)
None
5IP  A 401 (-3.8A)
0.73A 1xwfA-3mozA:
undetectable
1xwfA-3mozA:
20.32
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.
1XWF_B_ADNB433_2
(ADENOSYLHOMOCYSTEINA
SE)
3moz MYO-INOSITOL
HEXAPHOSPHATE
PHOSPHOHYDROLASE

(Selenomonas
ruminantium)
3 / 3 THR A 259
GLU A 136
HIS A 224
PO4  A 400 (-3.8A)
None
5IP  A 401 (-3.8A)
0.77A 1xwfB-3mozA:
undetectable
1xwfB-3mozA:
20.32
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.
1XWF_C_ADNC433_2
(ADENOSYLHOMOCYSTEINA
SE)
3moz MYO-INOSITOL
HEXAPHOSPHATE
PHOSPHOHYDROLASE

(Selenomonas
ruminantium)
3 / 3 THR A 259
GLU A 136
HIS A 224
PO4  A 400 (-3.8A)
None
5IP  A 401 (-3.8A)
0.79A 1xwfC-3mozA:
undetectable
1xwfC-3mozA:
20.32
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.
1XWF_D_ADND433_2
(ADENOSYLHOMOCYSTEINA
SE)
3moz MYO-INOSITOL
HEXAPHOSPHATE
PHOSPHOHYDROLASE

(Selenomonas
ruminantium)
3 / 3 THR A 259
GLU A 136
HIS A 224
PO4  A 400 (-3.8A)
None
5IP  A 401 (-3.8A)
0.76A 1xwfD-3mozA:
undetectable
1xwfD-3mozA:
20.32
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.
2BR4_A_SAMA301_1
(CEPHALOSPORIN
HYDROXYLASE CMCI)
3moz MYO-INOSITOL
HEXAPHOSPHATE
PHOSPHOHYDROLASE

(Selenomonas
ruminantium)
3 / 3 LYS A 312
ASP A 153
ASP A  59
5IP  A 401 (-3.0A)
5IP  A 401 ( 4.9A)
None
1.13A 2br4A-3mozA:
undetectable
2br4A-3mozA:
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.
4GKH_K_KANK301_1
(AMINOGLYCOSIDE
3'-PHOSPHOTRANSFERAS
E APHA1-IAB)
3moz MYO-INOSITOL
HEXAPHOSPHATE
PHOSPHOHYDROLASE

(Selenomonas
ruminantium)
4 / 8 ASP A 153
ASP A 132
GLU A 253
GLU A 168
5IP  A 401 ( 4.9A)
None
None
None
1.02A 4gkhC-3mozA:
undetectable
4gkhK-3mozA:
undetectable
4gkhC-3mozA:
20.85
4gkhK-3mozA:
20.85
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.
4GKI_G_KANG301_1
(AMINOGLYCOSIDE
3'-PHOSPHOTRANSFERAS
E APHA1-IAB)
3moz MYO-INOSITOL
HEXAPHOSPHATE
PHOSPHOHYDROLASE

(Selenomonas
ruminantium)
4 / 8 ASP A 153
ASP A 132
GLU A 253
GLU A 168
5IP  A 401 ( 4.9A)
None
None
None
1.03A 4gkiE-3mozA:
undetectable
4gkiG-3mozA:
undetectable
4gkiE-3mozA:
20.85
4gkiG-3mozA:
20.85