SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '4s1a'

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.
2C12_C_SPMC1434_1
(NITROALKANE OXIDASE)		 4s1a UNCHARACTERIZED
PROTEIN
(Ruminiclostridiu
m
thermocellum) 		5 / 12 LEU A 188
VAL A 143
ALA A 142
LEU A 181
VAL A 180
 None
 1.16A 2c12C-4s1aA:
undetectable		 2c12C-4s1aA:
19.77
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.
3B2R_A_VDNA1_1
(CGMP-SPECIFIC
3',5'-CYCLIC
PHOSPHODIESTERASE)		 4s1a UNCHARACTERIZED
PROTEIN
(Ruminiclostridiu
m
thermocellum) 		5 / 12 ILE A 238
LEU A 218
ALA A 222
ILE A 219
PHE A 265
 None
 0.96A 3b2rA-4s1aA:
undetectable		 3b2rA-4s1aA:
20.00
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.
3B2R_B_VDNB1_1
(CGMP-SPECIFIC
3',5'-CYCLIC
PHOSPHODIESTERASE)		 4s1a UNCHARACTERIZED
PROTEIN
(Ruminiclostridiu
m
thermocellum) 		5 / 11 ILE A 238
LEU A 218
ALA A 222
ILE A 219
PHE A 265
 None
 0.95A 3b2rB-4s1aA:
undetectable		 3b2rB-4s1aA:
20.00
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.
3KO0_A_TFPA202_1
(PROTEIN S100-A4)		 4s1a UNCHARACTERIZED
PROTEIN
(Ruminiclostridiu
m
thermocellum) 		5 / 12 LEU A  95
ILE A 120
LEU A 114
ASP A 113
PHE A 162
 None
 1.15A 3ko0A-4s1aA:
undetectable
3ko0B-4s1aA:
undetectable
3ko0C-4s1aA:
undetectable
3ko0D-4s1aA:
undetectable		 3ko0A-4s1aA:
18.98
3ko0B-4s1aA:
18.98
3ko0C-4s1aA:
18.98
3ko0D-4s1aA:
18.98
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.
3KO0_I_TFPI202_1
(PROTEIN S100-A4)		 4s1a UNCHARACTERIZED
PROTEIN
(Ruminiclostridiu
m
thermocellum) 		5 / 12 PHE A 162
LEU A  95
ILE A 120
LEU A 114
ASP A 113
 None
 1.16A 3ko0G-4s1aA:
undetectable
3ko0H-4s1aA:
undetectable
3ko0I-4s1aA:
undetectable
3ko0J-4s1aA:
undetectable		 3ko0G-4s1aA:
18.98
3ko0H-4s1aA:
18.98
3ko0I-4s1aA:
18.98
3ko0J-4s1aA:
18.98
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.
3KO0_J_TFPJ202_1
(PROTEIN S100-A4)		 4s1a UNCHARACTERIZED
PROTEIN
(Ruminiclostridiu
m
thermocellum) 		5 / 11 PHE A 162
LEU A 114
ASP A 113
LEU A  95
ILE A 120
 None
 1.12A 3ko0A-4s1aA:
undetectable
3ko0B-4s1aA:
undetectable
3ko0I-4s1aA:
undetectable
3ko0J-4s1aA:
undetectable		 3ko0A-4s1aA:
18.98
3ko0B-4s1aA:
18.98
3ko0I-4s1aA:
18.98
3ko0J-4s1aA:
18.98
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.
3KO0_K_TFPK202_1
(PROTEIN S100-A4)		 4s1a UNCHARACTERIZED
PROTEIN
(Ruminiclostridiu
m
thermocellum) 		5 / 12 LEU A  95
ILE A 120
LEU A 114
ASP A 113
PHE A 162
 None
 1.11A 3ko0K-4s1aA:
undetectable
3ko0L-4s1aA:
undetectable
3ko0S-4s1aA:
undetectable
3ko0T-4s1aA:
undetectable		 3ko0K-4s1aA:
18.98
3ko0L-4s1aA:
18.98
3ko0S-4s1aA:
18.98
3ko0T-4s1aA:
18.98
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.
3KO0_L_TFPL202_1
(PROTEIN S100-A4)		 4s1a UNCHARACTERIZED
PROTEIN
(Ruminiclostridiu
m
thermocellum) 		5 / 12 LEU A 114
ASP A 113
LEU A  95
ILE A 120
PHE A 162
 None
 1.08A 3ko0K-4s1aA:
undetectable
3ko0L-4s1aA:
undetectable
3ko0M-4s1aA:
undetectable
3ko0N-4s1aA:
undetectable		 3ko0K-4s1aA:
18.98
3ko0L-4s1aA:
18.98
3ko0M-4s1aA:
18.98
3ko0N-4s1aA:
18.98
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.
3KO0_M_TFPM202_1
(PROTEIN S100-A4)		 4s1a UNCHARACTERIZED
PROTEIN
(Ruminiclostridiu
m
thermocellum) 		5 / 12 LEU A  95
ILE A 120
LEU A 114
ASP A 113
PHE A 162
 None
 1.10A 3ko0M-4s1aA:
undetectable
3ko0N-4s1aA:
undetectable
3ko0O-4s1aA:
undetectable
3ko0P-4s1aA:
undetectable		 3ko0M-4s1aA:
18.98
3ko0N-4s1aA:
18.98
3ko0O-4s1aA:
18.98
3ko0P-4s1aA:
18.98
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.
3KO0_P_TFPP202_1
(PROTEIN S100-A4)		 4s1a UNCHARACTERIZED
PROTEIN
(Ruminiclostridiu
m
thermocellum) 		5 / 12 PHE A 162
LEU A 114
ASP A 113
LEU A  95
ILE A 120
 None
 1.07A 3ko0M-4s1aA:
undetectable
3ko0N-4s1aA:
undetectable
3ko0O-4s1aA:
undetectable
3ko0P-4s1aA:
undetectable		 3ko0M-4s1aA:
18.98
3ko0N-4s1aA:
18.98
3ko0O-4s1aA:
18.98
3ko0P-4s1aA:
18.98
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.
3UQ6_B_ADNB401_2
(ADENOSINE KINASE,
PUTATIVE)		 4s1a UNCHARACTERIZED
PROTEIN
(Ruminiclostridiu
m
thermocellum) 		4 / 5 LEU A 287
GLY A 284
PHE A 240
ASN A 263
 None
 1.29A 3uq6B-4s1aA:
undetectable		 3uq6B-4s1aA:
22.75
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.
4H1N_A_CGEA505_1
(CYTOCHROME P450 2B4)		 4s1a UNCHARACTERIZED
PROTEIN
(Ruminiclostridiu
m
thermocellum) 		5 / 11 ILE A 127
ILE A 219
LEU A 278
ALA A 225
ILE A 140
 None
 0.97A 4h1nA-4s1aA:
undetectable		 4h1nA-4s1aA:
19.29
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.
4V2Z_C_Y70C151_1
(CEREBLON ISOFORM 4)		 4s1a UNCHARACTERIZED
PROTEIN
(Ruminiclostridiu
m
thermocellum) 		4 / 8 PRO A 209
PHE A 251
PHE A 176
TRP A 206
 None
 1.49A 4v2zC-4s1aA:
undetectable		 4v2zC-4s1aA:
22.01
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.
5XOO_A_ADNA506_1
(GLYCOSAMINOGLYCAN
XYLOSYLKINASE)		 4s1a UNCHARACTERIZED
PROTEIN
(Ruminiclostridiu
m
thermocellum) 		4 / 6 TYR A 153
LEU A 173
LYS A 228
GLU A 224
 None
 1.40A 5xooA-4s1aA:
undetectable		 5xooA-4s1aA:
20.67
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.
6QYA_B_FOZB401_0
(THYMIDYLATE SYNTHASE)		 4s1a UNCHARACTERIZED
PROTEIN
(Ruminiclostridiu
m
thermocellum) 		5 / 12 LEU A 278
ILE A 233
LEU A 218
PHE A 235
ILE A 221
 None
 1.40A 6qyaB-4s1aA:
undetectable		 6qyaB-4s1aA:
21.52