SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '4iqy'

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.
1C6Y_B_MK1B524_2
(PROTEIN (PROTEASE))		 4iqy O-ACETYL-ADP-RIBOSE
DEACETYLASE MACROD2
(Homo
sapiens) 		5 / 12 GLY A 191
ALA A 149
GLY A 146
ILE A 185
ILE A 153
 None
 0.93A 1c6yB-4iqyA:
undetectable		 1c6yB-4iqyA:
18.22
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.
1MUI_B_AB1B100_1
(PROTEASE)		 4iqy O-ACETYL-ADP-RIBOSE
DEACETYLASE MACROD2
(Homo
sapiens) 		5 / 10 GLY A 191
ALA A 149
GLY A 146
ILE A 185
ILE A 153
 None
 0.97A 1muiA-4iqyA:
undetectable		 1muiA-4iqyA:
19.01
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.
2F80_B_017B301_1
(POL POLYPROTEIN)		 4iqy O-ACETYL-ADP-RIBOSE
DEACETYLASE MACROD2
(Homo
sapiens) 		5 / 12 GLY A 191
ALA A 149
GLY A 146
ILE A 185
ILE A 153
 None
 0.95A 2f80A-4iqyA:
undetectable		 2f80A-4iqyA:
18.75
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.
2F80_B_017B301_2
(POL POLYPROTEIN)		 4iqy O-ACETYL-ADP-RIBOSE
DEACETYLASE MACROD2
(Homo
sapiens) 		5 / 12 GLY A 191
ALA A 149
GLY A 146
ILE A 185
ILE A 153
 None
 0.96A 2f80B-4iqyA:
undetectable		 2f80B-4iqyA:
18.75
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.
2HS2_A_017A201_1
(PROTEASE)		 4iqy O-ACETYL-ADP-RIBOSE
DEACETYLASE MACROD2
(Homo
sapiens) 		5 / 12 GLY A 191
ALA A 149
GLY A 146
ILE A 185
ILE A 153
 None
 0.84A 2hs2A-4iqyA:
undetectable		 2hs2A-4iqyA:
18.81
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.
2PYM_A_1UNA1001_1
(PROTEASE RETROPEPSIN)		 4iqy O-ACETYL-ADP-RIBOSE
DEACETYLASE MACROD2
(Homo
sapiens) 		5 / 12 GLY A 191
ALA A 149
GLY A 146
ILE A 185
ILE A 153
 None
 0.91A 2pymA-4iqyA:
undetectable		 2pymA-4iqyA:
19.72
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.
2PYM_A_1UNA1001_2
(PROTEASE RETROPEPSIN)		 4iqy O-ACETYL-ADP-RIBOSE
DEACETYLASE MACROD2
(Homo
sapiens) 		5 / 12 GLY A 191
ALA A 149
GLY A 146
ILE A 185
ILE A 153
 None
 0.92A 2pymB-4iqyA:
undetectable		 2pymB-4iqyA:
19.72
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.
2PYN_A_1UNA1001_1
(PROTEASE RETROPEPSIN)		 4iqy O-ACETYL-ADP-RIBOSE
DEACETYLASE MACROD2
(Homo
sapiens) 		5 / 12 GLY A 191
ALA A 149
GLY A 146
ILE A 185
ILE A 153
 None
 0.97A 2pynA-4iqyA:
undetectable		 2pynA-4iqyA:
18.64
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.
2PYN_A_1UNA1001_2
(PROTEASE RETROPEPSIN)		 4iqy O-ACETYL-ADP-RIBOSE
DEACETYLASE MACROD2
(Homo
sapiens) 		5 / 12 GLY A 191
ALA A 149
GLY A 146
ILE A 185
ILE A 153
 None
 0.97A 2pynB-4iqyA:
undetectable		 2pynB-4iqyA:
18.64
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.
2Q63_A_1UNA1001_3
(PROTEASE RETROPEPSIN)		 4iqy O-ACETYL-ADP-RIBOSE
DEACETYLASE MACROD2
(Homo
sapiens) 		5 / 12 GLY A 191
ALA A 149
GLY A 146
ILE A 185
ILE A 153
 None
 0.97A 2q63B-4iqyA:
undetectable		 2q63B-4iqyA:
19.01
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.
2QAK_A_1UNA1001_3
(PROTEASE RETROPEPSIN)		 4iqy O-ACETYL-ADP-RIBOSE
DEACETYLASE MACROD2
(Homo
sapiens) 		5 / 12 GLY A 191
ALA A 149
GLY A 146
ILE A 185
ILE A 153
 None
 0.97A 2qakB-4iqyA:
undetectable		 2qakB-4iqyA:
19.01
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.
2R5Q_D_1UND900_2
(PROTEASE)		 4iqy O-ACETYL-ADP-RIBOSE
DEACETYLASE MACROD2
(Homo
sapiens) 		5 / 10 GLY A 191
ALA A 149
GLY A 146
ILE A 185
ILE A 153
 None
 0.93A 2r5qD-4iqyA:
undetectable		 2r5qD-4iqyA:
18.14
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.
3D1X_A_ROCA201_1
(HIV-1 PROTEASE)		 4iqy O-ACETYL-ADP-RIBOSE
DEACETYLASE MACROD2
(Homo
sapiens) 		5 / 12 GLY A 191
ALA A 149
GLY A 146
ILE A 185
ILE A 153
 None
 0.81A 3d1xA-4iqyA:
undetectable		 3d1xA-4iqyA:
17.80
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.
3D1Z_B_017B201_1
(HIV-1 PROTEASE)		 4iqy O-ACETYL-ADP-RIBOSE
DEACETYLASE MACROD2
(Homo
sapiens) 		5 / 12 GLY A 191
ALA A 149
GLY A 146
ILE A 185
ILE A 153
 None
 0.89A 3d1zA-4iqyA:
undetectable		 3d1zA-4iqyA:
17.80
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.
3D20_A_017A201_1
(HIV-1 PROTEASE)		 4iqy O-ACETYL-ADP-RIBOSE
DEACETYLASE MACROD2
(Homo
sapiens) 		5 / 12 GLY A 191
ALA A 149
GLY A 146
ILE A 185
ILE A 153
 None
 0.99A 3d20A-4iqyA:
undetectable		 3d20A-4iqyA:
17.80
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.
3D41_A_FCNA4001_1
(FOMA PROTEIN)		 4iqy O-ACETYL-ADP-RIBOSE
DEACETYLASE MACROD2
(Homo
sapiens) 		4 / 8 GLY A  98
GLY A 103
HIS A 106
ILE A 105
 AR6  A 301 ( 3.7A)
None
None
None
 0.68A 3d41A-4iqyA:
undetectable		 3d41A-4iqyA:
22.26
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.
3EKX_B_1UNB201_1
(PROTEASE)		 4iqy O-ACETYL-ADP-RIBOSE
DEACETYLASE MACROD2
(Homo
sapiens) 		5 / 11 GLY A 191
ALA A 149
GLY A 146
ILE A 185
ILE A 153
 None
 0.87A 3ekxA-4iqyA:
undetectable		 3ekxA-4iqyA:
19.07
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.
3EKY_A_DR7A100_1
(PROTEASE)		 4iqy O-ACETYL-ADP-RIBOSE
DEACETYLASE MACROD2
(Homo
sapiens) 		5 / 10 GLY A 191
ALA A 149
GLY A 146
ILE A 185
ILE A 153
 None
 0.98A 3ekyA-4iqyA:
undetectable		 3ekyA-4iqyA:
19.07
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.
3MWS_B_017B201_1
(HIV-1 PROTEASE)		 4iqy O-ACETYL-ADP-RIBOSE
DEACETYLASE MACROD2
(Homo
sapiens) 		5 / 12 GLY A 191
ALA A 149
GLY A 146
ILE A 185
ILE A 153
 None
 0.89A 3mwsA-4iqyA:
undetectable		 3mwsA-4iqyA:
15.90
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.
3PWM_B_017B402_1
(PROTEASE)		 4iqy O-ACETYL-ADP-RIBOSE
DEACETYLASE MACROD2
(Homo
sapiens) 		5 / 12 GLY A 191
ALA A 149
GLY A 146
ILE A 185
ILE A 153
 None
 0.98A 3pwmA-4iqyA:
undetectable		 3pwmA-4iqyA:
17.80
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.
3PWR_A_ROCA401_1
(PROTEASE)		 4iqy O-ACETYL-ADP-RIBOSE
DEACETYLASE MACROD2
(Homo
sapiens) 		5 / 12 GLY A 191
ALA A 149
GLY A 146
ILE A 185
ILE A 153
 None
 1.00A 3pwrA-4iqyA:
undetectable		 3pwrA-4iqyA:
17.80
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.
3TKG_B_ROCB801_2
(PROTEASE)		 4iqy O-ACETYL-ADP-RIBOSE
DEACETYLASE MACROD2
(Homo
sapiens) 		5 / 12 GLY A 191
ALA A 149
GLY A 146
ILE A 185
ILE A 153
 None
 1.01A 3tkgB-4iqyA:
undetectable		 3tkgB-4iqyA:
17.80
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.
5M50_E_TA1E502_1
(TUBULIN BETA-2B
CHAIN)		 4iqy O-ACETYL-ADP-RIBOSE
DEACETYLASE MACROD2
(Homo
sapiens) 		5 / 12 VAL A 101
ASP A 102
THR A 204
GLY A 146
LEU A 161
 AR6  A 301 (-3.9A)
AR6  A 301 (-3.6A)
None
None
None
 1.30A 5m50E-4iqyA:
2.1		 5m50E-4iqyA:
21.15
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.
5MRA_B_DM2B204_1
(SORCIN)		 4iqy O-ACETYL-ADP-RIBOSE
DEACETYLASE MACROD2
(Homo
sapiens) 		4 / 6 THR A  80
ARG A  32
ASP A 135
GLY A 110
 AR6  A 301 ( 4.8A)
None
None
None
 0.84A 5mraA-4iqyA:
undetectable
5mraB-4iqyA:
undetectable		 5mraA-4iqyA:
20.33
5mraB-4iqyA:
20.33
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.
5NKN_A_LOCA201_2
(NEUTROPHIL
GELATINASE-ASSOCIATE
D LIPOCALIN)		 4iqy O-ACETYL-ADP-RIBOSE
DEACETYLASE MACROD2
(Homo
sapiens) 		3 / 3 VAL A 227
LYS A 233
MET A 236
 None
 1.07A 5nknA-4iqyA:
undetectable		 5nknA-4iqyA:
14.17
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.
5T2Z_B_017B201_1
(PROTEASE)		 4iqy O-ACETYL-ADP-RIBOSE
DEACETYLASE MACROD2
(Homo
sapiens) 		5 / 12 GLY A 191
ALA A 149
GLY A 146
ILE A 185
ILE A 153
 None
 0.90A 5t2zA-4iqyA:
undetectable		 5t2zA-4iqyA:
16.06
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.
6DH3_A_017A101_1
(PROTEASE)		 4iqy O-ACETYL-ADP-RIBOSE
DEACETYLASE MACROD2
(Homo
sapiens) 		5 / 12 GLY A 191
ALA A 149
GLY A 146
ILE A 185
ILE A 153
 None
 0.95A 6dh3B-4iqyA:
undetectable		 6dh3B-4iqyA:
17.39