SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '2nqa'

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.
1S9Q_B_CHDB500_0
(ESTROGEN-RELATED
RECEPTOR GAMMA)		 2nqa CALPAIN 8
(Homo
sapiens) 		4 / 4 LEU A 281
VAL A 269
ILE A 282
TRP A 297
 None
 1.27A 1s9qB-2nqaA:
undetectable		 1s9qB-2nqaA:
23.37
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.
1SBR_A_VIBA502_1
(YKOF)		 2nqa CALPAIN 8
(Homo
sapiens) 		4 / 6 ALA A 110
LEU A 108
ILE A  97
SER A 265
 None
None
CSO  A  98 ( 4.0A)
None
 1.06A 1sbrA-2nqaA:
undetectable
1sbrB-2nqaA:
undetectable		 1sbrA-2nqaA:
20.80
1sbrB-2nqaA:
20.80
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.
3AI8_A_HNQA255_1
(CATHEPSIN B)		 2nqa CALPAIN 8
(Homo
sapiens) 		4 / 7 GLN A  99
GLY A 103
HIS A 262
TRP A 288
 None
 0.52A 3ai8A-2nqaA:
6.5		 3ai8A-2nqaA:
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.
4FP9_A_SAMA401_1
(METHYLTRANSFERASE
NSUN4)		 2nqa CALPAIN 8
(Homo
sapiens) 		3 / 3 ASP A 156
ARG A  77
ASP A 130
 None
 0.65A 4fp9A-2nqaA:
undetectable		 4fp9A-2nqaA:
23.54
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.
4FP9_C_SAMC401_1
(METHYLTRANSFERASE
NSUN4)		 2nqa CALPAIN 8
(Homo
sapiens) 		3 / 3 ASP A 156
ARG A  77
ASP A 130
 None
 0.54A 4fp9C-2nqaA:
undetectable		 4fp9C-2nqaA:
23.54
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.
4FP9_F_SAMF401_1
(METHYLTRANSFERASE
NSUN4)		 2nqa CALPAIN 8
(Homo
sapiens) 		3 / 3 ASP A 156
ARG A  77
ASP A 130
 None
 0.58A 4fp9F-2nqaA:
undetectable		 4fp9F-2nqaA:
23.54
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.
4IAQ_A_2GMA2001_2
(CHIMERA PROTEIN OF
HUMAN
5-HYDROXYTRYPTAMINE
RECEPTOR 1B AND E.
COLI SOLUBLE
CYTOCHROME B562)		 2nqa CALPAIN 8
(Homo
sapiens) 		4 / 6 TRP A 106
ILE A 111
THR A 115
ASP A 206
 None
 1.10A 4iaqA-2nqaA:
undetectable		 4iaqA-2nqaA:
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.
4UW0_A_SAMA1506_0
(WBDD)		 2nqa CALPAIN 8
(Homo
sapiens) 		5 / 12 GLY A 239
ALA A 263
PHE A 335
VAL A 266
ILE A 282
 None
 1.01A 4uw0A-2nqaA:
undetectable		 4uw0A-2nqaA:
21.40
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.
5A06_A_SORA1342_0
(ALDOSE-ALDOSE
OXIDOREDUCTASE)		 2nqa CALPAIN 8
(Homo
sapiens) 		4 / 7 LEU A 166
GLU A 182
GLY A 100
GLY A 101
 None
None
CSO  A  98 ( 4.5A)
None
 0.80A 5a06A-2nqaA:
undetectable		 5a06A-2nqaA:
22.22
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.
5A06_B_SORB1342_0
(ALDOSE-ALDOSE
OXIDOREDUCTASE)		 2nqa CALPAIN 8
(Homo
sapiens) 		4 / 7 LEU A 166
GLU A 182
GLY A 100
GLY A 101
 None
None
CSO  A  98 ( 4.5A)
None
 0.83A 5a06B-2nqaA:
undetectable		 5a06B-2nqaA:
22.22
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.
5A06_C_SORC1342_0
(ALDOSE-ALDOSE
OXIDOREDUCTASE)		 2nqa CALPAIN 8
(Homo
sapiens) 		4 / 7 LEU A 166
GLU A 182
GLY A 100
GLY A 101
 None
None
CSO  A  98 ( 4.5A)
None
 0.80A 5a06C-2nqaA:
undetectable		 5a06C-2nqaA:
22.22
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.
5A06_E_SORE1341_0
(ALDOSE-ALDOSE
OXIDOREDUCTASE)		 2nqa CALPAIN 8
(Homo
sapiens) 		4 / 7 LEU A 166
GLU A 182
GLY A 100
GLY A 101
 None
None
CSO  A  98 ( 4.5A)
None
 0.81A 5a06E-2nqaA:
undetectable		 5a06E-2nqaA:
22.22
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.
5A06_F_SORF1341_0
(ALDOSE-ALDOSE
OXIDOREDUCTASE)		 2nqa CALPAIN 8
(Homo
sapiens) 		4 / 7 LEU A 166
GLU A 182
GLY A 100
GLY A 101
 None
None
CSO  A  98 ( 4.5A)
None
 0.81A 5a06F-2nqaA:
undetectable		 5a06F-2nqaA:
22.22
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.
5E5J_A_017A201_3
(PROTEASE)		 2nqa CALPAIN 8
(Homo
sapiens) 		3 / 3 ASP A 216
VAL A 332
LEU A 224
 None
 0.65A 5e5jB-2nqaA:
undetectable		 5e5jB-2nqaA:
15.14
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.
5ESL_A_1YNA701_2
(LANOSTEROL 14-ALPHA
DEMETHYLASE)		 2nqa CALPAIN 8
(Homo
sapiens) 		4 / 5 ALA A 136
TYR A 135
GLY A  72
LEU A  81
 None
None
None
CSO  A  82 ( 4.4A)
 0.84A 5eslA-2nqaA:
undetectable		 5eslA-2nqaA:
20.07
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.
5GTR_A_ESTA601_2
(ESTROGEN RECEPTOR)		 2nqa CALPAIN 8
(Homo
sapiens) 		4 / 5 LEU A 284
LEU A 232
PHE A 331
LEU A 338
 None
CSO  A 233 ( 4.3A)
None
None
 0.97A 5gtrA-2nqaA:
undetectable		 5gtrA-2nqaA:
22.51
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.
5SYF_B_TA1B502_1
(TUBULIN BETA CHAIN)		 2nqa CALPAIN 8
(Homo
sapiens) 		5 / 12 ASP A 155
ALA A 179
PRO A  78
ARG A  77
LEU A  81
 None
None
None
None
CSO  A  82 ( 4.4A)
 1.27A 5syfB-2nqaA:
undetectable		 5syfB-2nqaA:
20.37
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.
6JNH_A_ASCA202_0
(PHOSPHOPANTETHEINE
ADENYLYLTRANSFERASE)		 2nqa CALPAIN 8
(Homo
sapiens) 		3 / 3 ASN A 174
PRO A  85
GLN A 132
 CSO  A  82 ( 4.7A)
CSO  A  82 ( 4.1A)
None
 0.93A 6jnhA-2nqaA:
undetectable		 6jnhA-2nqaA:
20.74
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.
6JOG_A_ASCA202_0
(PHOSPHOPANTETHEINE
ADENYLYLTRANSFERASE)		 2nqa CALPAIN 8
(Homo
sapiens) 		3 / 3 ASN A 174
PRO A  85
GLN A 132
 CSO  A  82 ( 4.7A)
CSO  A  82 ( 4.1A)
None
 0.93A 6jogA-2nqaA:
undetectable		 6jogA-2nqaA:
20.74