SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '046'


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.
2HYY_C_STIC600_2
(PROTO-ONCOGENE
TYROSINE-PROTEIN
KINASE ABL1)
4o2z MITOGEN-ACTIVATED
PROTEIN KINASE 3,
PUTATIVE

(Leishmania
donovani)
4 / 6 LEU A  53
LYS A  76
MET A  98
MET A 133
046  A 401 ( 3.9A)
046  A 401 ( 4.7A)
046  A 401 (-3.5A)
None
0.91A 2hyyC-4o2zA:
22.1
2hyyC-4o2zA:
24.52
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.
2YFB_B_ACTB501_0
(METHYL-ACCEPTING
CHEMOTAXIS
TRANSDUCER)
4o2z MITOGEN-ACTIVATED
PROTEIN KINASE 3,
PUTATIVE

(Leishmania
donovani)
4 / 6 ASP A 175
ARG A 217
VAL A 232
ARG A 174
046  A 401 (-4.4A)
None
None
None
1.20A 2yfbB-4o2zA:
2.2
2yfbB-4o2zA:
21.73
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.
3BJW_F_SVRF502_3
(PHOSPHOLIPASE A2)
5mzn HELICASE
SEN1,HELICASE SEN1

(Saccharomyces
cerevisiae)
5 / 12 VAL A1427
LEU A1368
GLY A1369
ILE A1343
PHE A1374
None
EDO  A2014 (-4.2A)
None
None
GOL  A2046 ( 4.2A)
1.02A 3bjwF-5mznA:
undetectable
3bjwF-5mznA:
11.08
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.
3CS9_B_NILB600_1
(PROTO-ONCOGENE
TYROSINE-PROTEIN
KINASE ABL1)
4o2z MITOGEN-ACTIVATED
PROTEIN KINASE 3,
PUTATIVE

(Leishmania
donovani)
6 / 12 GLU A  94
MET A  98
LEU A 106
THR A 130
HIS A 173
ASP A 193
046  A 401 (-3.7A)
046  A 401 (-3.5A)
046  A 401 ( 4.6A)
046  A 401 (-4.0A)
046  A 401 (-4.1A)
046  A 401 (-4.3A)
0.69A 3cs9B-4o2zA:
21.3
3cs9B-4o2zA:
26.21
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.
3CS9_C_NILC600_1
(PROTO-ONCOGENE
TYROSINE-PROTEIN
KINASE ABL1)
4o2z MITOGEN-ACTIVATED
PROTEIN KINASE 3,
PUTATIVE

(Leishmania
donovani)
6 / 12 GLU A  94
MET A  98
LEU A 106
THR A 130
HIS A 173
ASP A 193
046  A 401 (-3.7A)
046  A 401 (-3.5A)
046  A 401 ( 4.6A)
046  A 401 (-4.0A)
046  A 401 (-4.1A)
046  A 401 (-4.3A)
0.67A 3cs9C-4o2zA:
21.1
3cs9C-4o2zA:
26.21
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.
3IK3_A_0LIA1_1
(PROTO-ONCOGENE
TYROSINE-PROTEIN
KINASE ABL1)
4o2z MITOGEN-ACTIVATED
PROTEIN KINASE 3,
PUTATIVE

(Leishmania
donovani)
5 / 12 GLU A  94
MET A  98
LEU A 106
HIS A 173
ASP A 193
046  A 401 (-3.7A)
046  A 401 (-3.5A)
046  A 401 ( 4.6A)
046  A 401 (-4.1A)
046  A 401 (-4.3A)
0.59A 3ik3A-4o2zA:
21.6
3ik3A-4o2zA:
24.93
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3IK3_B_0LIB2_1
(PROTO-ONCOGENE
TYROSINE-PROTEIN
KINASE ABL1)
4o2z MITOGEN-ACTIVATED
PROTEIN KINASE 3,
PUTATIVE

(Leishmania
donovani)
5 / 12 GLU A  94
MET A  98
LEU A 106
HIS A 173
ASP A 193
046  A 401 (-3.7A)
046  A 401 (-3.5A)
046  A 401 ( 4.6A)
046  A 401 (-4.1A)
046  A 401 (-4.3A)
0.63A 3ik3B-4o2zA:
21.6
3ik3B-4o2zA:
24.93
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3IV6_D_SAMD301_0
(PUTATIVE
ZN-DEPENDENT ALCOHOL
DEHYDROGENASE)
4o2z MITOGEN-ACTIVATED
PROTEIN KINASE 3,
PUTATIVE

(Leishmania
donovani)
5 / 12 THR A 213
ILE A 159
ASP A 175
ARG A 174
LEU A 176
None
None
046  A 401 (-4.4A)
None
None
1.23A 3iv6D-4o2zA:
undetectable
3iv6D-4o2zA:
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.
3OXZ_A_0LIA1_1
(TYROSINE-PROTEIN
KINASE ABL1)
4o2z MITOGEN-ACTIVATED
PROTEIN KINASE 3,
PUTATIVE

(Leishmania
donovani)
6 / 12 GLU A  94
MET A  98
LEU A 106
THR A 130
HIS A 173
ASP A 193
046  A 401 (-3.7A)
046  A 401 (-3.5A)
046  A 401 ( 4.6A)
046  A 401 (-4.0A)
046  A 401 (-4.1A)
046  A 401 (-4.3A)
0.66A 3oxzA-4o2zA:
20.9
3oxzA-4o2zA:
25.75
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.
4FOR_A_FLPA711_1
(LACTOTRANSFERRIN)
5xym 50S RIBOSOMAL
PROTEIN L2

(Mycolicibacteriu
m
smegmatis)
4 / 7 GLY C 251
VAL C 247
PRO C 249
GLY C 223
G  A2466 ( 3.7A)
None
A  A2045 ( 3.9A)
C  A2046 ( 3.3A)
0.83A 4forA-5xymC:
undetectable
4forA-5xymC:
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.
4V01_A_0LIA1776_1
(FIBROBLAST GROWTH
FACTOR RECEPTOR 1
(FMS-RELATED
TYROSINE KINASE 2,
PFEIFFER SYNDROME),
ISOFORM CRA_B)
4o2z MITOGEN-ACTIVATED
PROTEIN KINASE 3,
PUTATIVE

(Leishmania
donovani)
6 / 12 GLU A  94
MET A  97
MET A  98
LEU A 166
HIS A 173
ASP A 193
046  A 401 (-3.7A)
046  A 401 (-3.9A)
046  A 401 (-3.5A)
None
046  A 401 (-4.1A)
046  A 401 (-4.3A)
0.77A 4v01A-4o2zA:
21.3
4v01A-4o2zA:
25.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4V01_B_0LIB1770_1
(FIBROBLAST GROWTH
FACTOR RECEPTOR 1
(FMS-RELATED
TYROSINE KINASE 2,
PFEIFFER SYNDROME),
ISOFORM CRA_B)
4o2z MITOGEN-ACTIVATED
PROTEIN KINASE 3,
PUTATIVE

(Leishmania
donovani)
6 / 12 ALA A  61
GLU A  94
MET A  97
MET A  98
HIS A 173
ASP A 193
046  A 401 ( 4.6A)
046  A 401 (-3.7A)
046  A 401 (-3.9A)
046  A 401 (-3.5A)
046  A 401 (-4.1A)
046  A 401 (-4.3A)
1.06A 4v01B-4o2zA:
21.8
4v01B-4o2zA:
25.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4V01_B_0LIB1770_1
(FIBROBLAST GROWTH
FACTOR RECEPTOR 1
(FMS-RELATED
TYROSINE KINASE 2,
PFEIFFER SYNDROME),
ISOFORM CRA_B)
4o2z MITOGEN-ACTIVATED
PROTEIN KINASE 3,
PUTATIVE

(Leishmania
donovani)
6 / 12 GLU A  94
MET A  97
MET A  98
LEU A 166
HIS A 173
ASP A 193
046  A 401 (-3.7A)
046  A 401 (-3.9A)
046  A 401 (-3.5A)
None
046  A 401 (-4.1A)
046  A 401 (-4.3A)
0.69A 4v01B-4o2zA:
21.8
4v01B-4o2zA:
25.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4V04_B_0LIB1771_2
(FIBROBLAST GROWTH
FACTOR RECEPTOR 1
(FMS-RELATED
TYROSINE KINASE 2,
PFEIFFER SYNDROME),
ISOFORM CRA_B)
4o2z MITOGEN-ACTIVATED
PROTEIN KINASE 3,
PUTATIVE

(Leishmania
donovani)
5 / 12 ALA A  61
GLU A  94
MET A  97
HIS A 173
ASP A 193
046  A 401 ( 4.6A)
046  A 401 (-3.7A)
046  A 401 (-3.9A)
046  A 401 (-4.1A)
046  A 401 (-4.3A)
0.91A 4v04B-4o2zA:
21.8
4v04B-4o2zA:
25.94