SIMILAR PATTERN OF AMINO ACIDS MAPPED TO 'PNS'


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.
2DR2_A_TRPA479_0
(TRYPTOPHANYL-TRNA
SYNTHETASE)		 4zxi TYROCIDINE
SYNTHETASE 3
(Acinetobacter
baumannii) 		5 / 11 GLY A 397
THR A 402
GLU A 404
GLN A 398
GLN A 395
 None
None
None
PNS  A1401 ( 4.3A)
None
 1.49A 2dr2A-4zxiA:
undetectable		 2dr2A-4zxiA:
14.85
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.
2WEY_A_EV1A1771_1
(CAMP AND
CAMP-INHIBITED CGMP
3', 5'-CYCLIC
PHOSPHODIESTERASE)		 2lml PUTATIVE ACYL
CARRIER PROTEIN
(Geobacter
metallireducens) 		5 / 12 LEU A  68
LEU A  42
VAL A  14
ILE A  31
PHE A  11
 PNS  A  88 (-4.7A)
None
None
None
None
 1.18A 2weyA-2lmlA:
undetectable		 2weyA-2lmlA:
14.04
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.
2XZ5_C_ACHC1211_0
(SOLUBLE
ACETYLCHOLINE
RECEPTOR)		 5isx GRAMICIDIN S
SYNTHASE 1
(Brevibacillus
brevis) 		4 / 8 THR A 913
GLN A 915
TYR A1015
TRP A 644
 PNS  A1200 (-3.6A)
None
None
None
 1.29A 2xz5A-5isxA:
undetectable
2xz5C-5isxA:
undetectable		 2xz5A-5isxA:
15.71
2xz5C-5isxA:
15.71
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.
3ADS_A_IMNA2_2
(PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA)		 4zxi TYROCIDINE
SYNTHETASE 3
(Acinetobacter
baumannii) 		4 / 6 ILE A 401
ILE A  27
TYR A  37
LEU A 417
 None
None
PNS  A1401 (-4.7A)
None
 1.14A 3adsA-4zxiA:
undetectable		 3adsA-4zxiA:
12.37
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.
3EL0_A_1UNA201_1
(PROTEASE)		 2fq0 ACYL CARRIER PROTEIN
(Plasmodium
falciparum) 		4 / 8 GLY A  34
ALA A  35
ASP A  36
ASP A  39
 PNS  A 137 ( 3.2A)
None
PNS  A 137 (-2.3A)
None
 0.66A 3el0A-2fq0A:
undetectable		 3el0A-2fq0A:
25.49
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.
3GWU_A_SREA801_1
(TRANSPORTER)		 5isx GRAMICIDIN S
SYNTHASE 1
(Brevibacillus
brevis) 		6 / 12 LEU A1000
LEU A 977
GLN A 979
TYR A 648
ASP A 983
THR A 982
 None
PNS  A1200 (-4.8A)
None
None
None
None
 1.43A 3gwuA-5isxA:
undetectable		 3gwuA-5isxA:
21.12
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.
3T3C_A_017A201_1
(HIV-1 PROTEASE)		 2fq0 ACYL CARRIER PROTEIN
(Plasmodium
falciparum) 		4 / 7 GLY A  34
ALA A  35
ASP A  36
ASP A  39
 PNS  A 137 ( 3.2A)
None
PNS  A 137 (-2.3A)
None
 0.74A 3t3cA-2fq0A:
undetectable		 3t3cA-2fq0A:
21.10
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.
4EYR_B_RITB301_2
(HIV-1 PROTEASE)		 2fq0 ACYL CARRIER PROTEIN
(Plasmodium
falciparum) 		4 / 8 GLY A  34
ALA A  35
ASP A  36
ASP A  39
 PNS  A 137 ( 3.2A)
None
PNS  A 137 (-2.3A)
None
 0.71A 4eyrB-2fq0A:
undetectable		 4eyrB-2fq0A:
25.49
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.
4IIZ_B_LURB201_1
(TRANSTHYRETIN)		 1od6 PHOSPHOPANTETHEINE
ADENYLYLTRANSFERASE
(Thermus
thermophilus) 		4 / 8 THR A  31
ALA A  33
LEU A  35
VAL A   4
 None
None
PNS  A1161 (-3.7A)
None
 0.73A 4iizB-1od6A:
undetectable		 4iizB-1od6A:
24.14
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.
4MM4_A_8PRA603_1
(TRANSPORTER)		 1od6 PHOSPHOPANTETHEINE
ADENYLYLTRANSFERASE
(Thermus
thermophilus) 		5 / 12 VAL A  32
ALA A  33
TYR A   5
GLY A   7
THR A  59
 None
None
None
PNS  A1161 (-3.6A)
None
 1.26A 4mm4A-1od6A:
undetectable		 4mm4A-1od6A:
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.
4PWJ_A_30ZA201_1
(TRANSTHYRETIN)		 1od6 PHOSPHOPANTETHEINE
ADENYLYLTRANSFERASE
(Thermus
thermophilus) 		4 / 6 THR A  31
ALA A  33
LEU A  35
SER A   8
 None
None
PNS  A1161 (-3.7A)
PNS  A1161 (-3.0A)
 0.77A 4pwjA-1od6A:
undetectable		 4pwjA-1od6A:
19.34
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.
4PWJ_B_30ZB201_1
(TRANSTHYRETIN)		 1od6 PHOSPHOPANTETHEINE
ADENYLYLTRANSFERASE
(Thermus
thermophilus) 		4 / 7 THR A  31
ALA A  33
LEU A  35
SER A   8
 None
None
PNS  A1161 (-3.7A)
PNS  A1161 (-3.0A)
 0.79A 4pwjB-1od6A:
undetectable		 4pwjB-1od6A:
19.34
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.
4QWP_A_GCSA303_1
(CHITOSANASE)		 5isx GRAMICIDIN S
SYNTHASE 1
(Brevibacillus
brevis) 		4 / 6 GLU A 892
ILE A 629
HIS A 753
TYR A1015
 PNS  A1200 ( 4.7A)
None
PNS  A1200 (-4.2A)
None
 1.00A 4qwpA-5isxA:
undetectable		 4qwpA-5isxA:
18.47
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.
4R38_A_RBFA201_1
(BLUE-LIGHT-ACTIVATED
HISTIDINE KINASE 2)		 5isx GRAMICIDIN S
SYNTHASE 1
(Brevibacillus
brevis) 		5 / 12 ALA A 750
ILE A 751
ASN A 998
LEU A1000
GLY A 758
 None
None
None
None
PNS  A1200 (-4.3A)
 1.22A 4r38A-5isxA:
undetectable		 4r38A-5isxA:
14.23
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.
5AQF_A_ADNA1382_1
(HEAT SHOCK COGNATE
71 KDA PROTEIN)		 5isx GRAMICIDIN S
SYNTHASE 1
(Brevibacillus
brevis) 		5 / 10 GLY A 910
GLY A 758
SER A 760
ARG A 762
ILE A 763
 None
PNS  A1200 (-4.3A)
None
None
None
 0.92A 5aqfA-5isxA:
2.0		 5aqfA-5isxA:
21.13
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.
5AQF_C_ADNC1382_1
(HEAT SHOCK COGNATE
71 KDA PROTEIN)		 5isx GRAMICIDIN S
SYNTHASE 1
(Brevibacillus
brevis) 		5 / 10 GLY A 910
GLY A 758
SER A 760
ARG A 762
ILE A 763
 None
PNS  A1200 (-4.3A)
None
None
None
 0.94A 5aqfC-5isxA:
undetectable		 5aqfC-5isxA:
21.13
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.
5AQY_A_ADNA1389_1
(HEAT SHOCK 70 KDA
PROTEIN 1A)		 5isx GRAMICIDIN S
SYNTHASE 1
(Brevibacillus
brevis) 		5 / 10 GLY A 910
GLY A 758
SER A 760
ARG A 762
ILE A 763
 None
PNS  A1200 (-4.3A)
None
None
None
 0.88A 5aqyA-5isxA:
undetectable		 5aqyA-5isxA:
21.66
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.
5BOJ_B_4TXB201_1
(TRANSTHYRETIN)		 1od6 PHOSPHOPANTETHEINE
ADENYLYLTRANSFERASE
(Thermus
thermophilus) 		4 / 7 THR A  31
ALA A  33
LEU A  35
SER A   8
 None
None
PNS  A1161 (-3.7A)
PNS  A1161 (-3.0A)
 0.80A 5bojB-1od6A:
undetectable		 5bojB-1od6A:
24.14
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
6JMJ_A_ASCA201_0
(PHOSPHOPANTETHEINE
ADENYLYLTRANSFERASE)		 1od6 PHOSPHOPANTETHEINE
ADENYLYLTRANSFERASE
(Thermus
thermophilus) 		4 / 5 GLY A   7
HIS A  16
SER A 128
SER A 129
 PNS  A1161 (-3.6A)
SO4  A1163 (-4.1A)
None
SO4  A1163 (-3.3A)
 0.31A 6jmjA-1od6A:
24.6		 6jmjA-1od6A:
49.69
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
6JMJ_A_ASCA201_0
(PHOSPHOPANTETHEINE
ADENYLYLTRANSFERASE)		 1vlh PHOSPHOPANTETHEINE
ADENYLYLTRANSFERASE
(Thermotoga
maritima) 		4 / 5 GLY A   7
HIS A  16
SER A 126
SER A 127
 PNS  A 200 (-3.3A)
None
None
None
 0.27A 6jmjA-1vlhA:
24.7		 6jmjA-1vlhA:
43.60
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
6JMJ_A_ASCA201_0
(PHOSPHOPANTETHEINE
ADENYLYLTRANSFERASE)		 3nbk PHOSPHOPANTETHEINE
ADENYLYLTRANSFERASE
(Mycobacterium
tuberculosis) 		4 / 5 GLY A   8
HIS A  17
SER A 126
SER A 127
 PNS  A 200 (-3.2A)
None
None
None
 0.34A 6jmjA-3nbkA:
24.7		 6jmjA-3nbkA:
38.04
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
6JNH_A_ASCA201_0
(PHOSPHOPANTETHEINE
ADENYLYLTRANSFERASE)		 1od6 PHOSPHOPANTETHEINE
ADENYLYLTRANSFERASE
(Thermus
thermophilus) 		6 / 7 GLY A   7
PHE A   9
HIS A  16
ARG A  91
SER A 128
SER A 129
 PNS  A1161 (-3.6A)
None
SO4  A1163 (-4.1A)
SO4  A1163 (-3.7A)
None
SO4  A1163 (-3.3A)
 0.64A 6jnhA-1od6A:
24.8		 6jnhA-1od6A:
49.69
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
6JNH_A_ASCA201_0
(PHOSPHOPANTETHEINE
ADENYLYLTRANSFERASE)		 1vlh PHOSPHOPANTETHEINE
ADENYLYLTRANSFERASE
(Thermotoga
maritima) 		5 / 7 GLY A   7
PHE A   9
HIS A  16
SER A 126
SER A 127
 PNS  A 200 (-3.3A)
None
None
None
None
 0.27A 6jnhA-1vlhA:
24.8		 6jnhA-1vlhA:
43.60
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
6JNH_A_ASCA201_0
(PHOSPHOPANTETHEINE
ADENYLYLTRANSFERASE)		 3nbk PHOSPHOPANTETHEINE
ADENYLYLTRANSFERASE
(Mycobacterium
tuberculosis) 		6 / 7 GLY A   8
PHE A  10
HIS A  17
ARG A  90
SER A 126
SER A 127
 PNS  A 200 (-3.2A)
None
None
None
None
None
 0.65A 6jnhA-3nbkA:
24.8		 6jnhA-3nbkA:
38.04
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
6JOG_A_ASCA201_0
(PHOSPHOPANTETHEINE
ADENYLYLTRANSFERASE)		 1od6 PHOSPHOPANTETHEINE
ADENYLYLTRANSFERASE
(Thermus
thermophilus) 		4 / 6 GLY A   7
ARG A  91
SER A 128
SER A 129
 PNS  A1161 (-3.6A)
SO4  A1163 (-3.7A)
None
SO4  A1163 (-3.3A)
 0.71A 6jogA-1od6A:
24.6		 6jogA-1od6A:
49.69
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
6JOG_A_ASCA201_0
(PHOSPHOPANTETHEINE
ADENYLYLTRANSFERASE)		 1od6 PHOSPHOPANTETHEINE
ADENYLYLTRANSFERASE
(Thermus
thermophilus) 		4 / 6 GLY A   7
HIS A  16
SER A 128
SER A 129
 PNS  A1161 (-3.6A)
SO4  A1163 (-4.1A)
None
SO4  A1163 (-3.3A)
 0.35A 6jogA-1od6A:
24.6		 6jogA-1od6A:
49.69
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
6JOG_A_ASCA201_0
(PHOSPHOPANTETHEINE
ADENYLYLTRANSFERASE)		 1vlh PHOSPHOPANTETHEINE
ADENYLYLTRANSFERASE
(Thermotoga
maritima) 		4 / 6 GLY A   7
HIS A  16
SER A 126
SER A 127
 PNS  A 200 (-3.3A)
None
None
None
 0.27A 6jogA-1vlhA:
24.7		 6jogA-1vlhA:
43.60
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
6JOG_A_ASCA201_0
(PHOSPHOPANTETHEINE
ADENYLYLTRANSFERASE)		 3nbk PHOSPHOPANTETHEINE
ADENYLYLTRANSFERASE
(Mycobacterium
tuberculosis) 		5 / 6 GLY A   8
HIS A  17
ARG A  90
SER A 126
SER A 127
 PNS  A 200 (-3.2A)
None
None
None
None
 0.66A 6jogA-3nbkA:
24.7		 6jogA-3nbkA:
38.04