SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '4dia'

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.
1YA3_B_STRB2001_1
(MINERALOCORTICOID
RECEPTOR)		 4dia 2-PYRONE-4,6-DICARBA
XYLATE HYDROLASE
(Sphingomonas
paucimobilis) 		5 / 12 ALA A 159
MET A 195
LEU A 201
ARG A 166
LEU A 235
 None
 1.26A 1ya3B-4diaA:
undetectable		 1ya3B-4diaA:
21.05
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.
2NYU_A_SAMA201_1
(PUTATIVE RIBOSOMAL
RNA
METHYLTRANSFERASE 2)		 4dia 2-PYRONE-4,6-DICARBA
XYLATE HYDROLASE
(Sphingomonas
paucimobilis) 		4 / 4 PRO A 223
ASP A 219
ASP A 185
ASP A 226
 None
 1.18A 2nyuA-4diaA:
undetectable		 2nyuA-4diaA:
20.92
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.
2X45_B_HSMB1160_1
(ALLERGEN ARG R 1)		 4dia 2-PYRONE-4,6-DICARBA
XYLATE HYDROLASE
(Sphingomonas
paucimobilis) 		4 / 7 VAL A  72
TYR A 290
ILE A 244
ASP A 179
 None
 1.22A 2x45B-4diaA:
undetectable		 2x45B-4diaA:
14.75
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.
2X45_C_HSMC1160_1
(ALLERGEN ARG R 1)		 4dia 2-PYRONE-4,6-DICARBA
XYLATE HYDROLASE
(Sphingomonas
paucimobilis) 		4 / 7 VAL A  72
TYR A 290
ILE A 244
ASP A 179
 None
 1.23A 2x45C-4diaA:
undetectable		 2x45C-4diaA:
14.75
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.
3JB2_A_SAMA1102_0
(STRUCTURAL PROTEIN
VP3)		 4dia 2-PYRONE-4,6-DICARBA
XYLATE HYDROLASE
(Sphingomonas
paucimobilis) 		5 / 12 ILE A  90
GLY A 119
GLY A 118
ALA A 114
ALA A 101
 None
 1.00A 3jb2A-4diaA:
undetectable		 3jb2A-4diaA:
15.05
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.
3MB5_A_SAMA301_0
(SAM-DEPENDENT
METHYLTRANSFERASE)		 4dia 2-PYRONE-4,6-DICARBA
XYLATE HYDROLASE
(Sphingomonas
paucimobilis) 		5 / 12 GLY A  99
ALA A 101
ILE A  28
ILE A 244
LEU A 289
 None
 0.89A 3mb5A-4diaA:
undetectable		 3mb5A-4diaA:
22.81
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.
3OI8_A_ADNA2_1
(UNCHARACTERIZED
PROTEIN)		 4dia 2-PYRONE-4,6-DICARBA
XYLATE HYDROLASE
(Sphingomonas
paucimobilis) 		4 / 6 HIS A 251
PRO A  16
LEU A  62
ASP A  29
 None
 1.18A 3oi8A-4diaA:
undetectable		 3oi8A-4diaA:
20.34
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.
3UR0_B_SVRB516_1
(RNA-DEPENDENT RNA
POLYMERASE)		 4dia 2-PYRONE-4,6-DICARBA
XYLATE HYDROLASE
(Sphingomonas
paucimobilis) 		4 / 7 PRO A  23
ALA A  27
ALA A  30
ASP A  29
 None
 0.81A 3ur0B-4diaA:
undetectable		 3ur0B-4diaA:
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.
3WSJ_A_MK1A201_1
(PROTEASE)		 4dia 2-PYRONE-4,6-DICARBA
XYLATE HYDROLASE
(Sphingomonas
paucimobilis) 		5 / 9 LEU A 289
ALA A  30
ASP A  29
LEU A 282
ILE A 244
 None
 1.39A 3wsjA-4diaA:
undetectable		 3wsjA-4diaA:
17.97
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.
4EAH_F_ACTF402_0
(ACTIN, ALPHA
SKELETAL MUSCLE)		 4dia 2-PYRONE-4,6-DICARBA
XYLATE HYDROLASE
(Sphingomonas
paucimobilis) 		3 / 3 PHE A 228
ASP A 226
ARG A 270
 None
 0.74A 4eahF-4diaA:
undetectable		 4eahF-4diaA:
21.84
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.
4EAH_G_ACTG401_0
(ACTIN, ALPHA
SKELETAL MUSCLE)		 4dia 2-PYRONE-4,6-DICARBA
XYLATE HYDROLASE
(Sphingomonas
paucimobilis) 		3 / 3 PHE A 228
ASP A 226
ARG A 270
 None
 0.73A 4eahG-4diaA:
undetectable		 4eahG-4diaA:
21.84
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.
4K50_B_ACTB701_0
(RNA (33-MER)
RNA POLYMERASE
3D-POL)		 4dia 2-PYRONE-4,6-DICARBA
XYLATE HYDROLASE
(Sphingomonas
paucimobilis) 		3 / 3 HIS A 152
GLY A  99
ILE A 100
 None
 0.61A 4k50A-4diaA:
undetectable		 4k50A-4diaA:
20.59
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.
4K50_J_ACTJ701_0
(RNA (33-MER)
RNA POLYMERASE
3D-POL)		 4dia 2-PYRONE-4,6-DICARBA
XYLATE HYDROLASE
(Sphingomonas
paucimobilis) 		3 / 3 HIS A 152
GLY A  99
ILE A 100
 None
 0.59A 4k50I-4diaA:
undetectable		 4k50I-4diaA:
20.59
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.
4MA3_L_ACTL301_0
(C2095 HEAVY CHAIN
C2095 LIGHT CHAIN)		 4dia 2-PYRONE-4,6-DICARBA
XYLATE HYDROLASE
(Sphingomonas
paucimobilis) 		3 / 3 PRO A 252
ASN A 248
HIS A  31
 None
 0.84A 4ma3H-4diaA:
undetectable
4ma3L-4diaA:
undetectable		 4ma3H-4diaA:
21.12
4ma3L-4diaA:
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.
4MA3_L_ACTL301_0
(C2095 HEAVY CHAIN
C2095 LIGHT CHAIN)		 4dia 2-PYRONE-4,6-DICARBA
XYLATE HYDROLASE
(Sphingomonas
paucimobilis) 		3 / 3 PRO A 252
ASN A 248
HIS A 180
 None
 0.95A 4ma3H-4diaA:
undetectable
4ma3L-4diaA:
undetectable		 4ma3H-4diaA:
21.12
4ma3L-4diaA:
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.
4U9U_A_ACTA1502_0
(NA(+)-TRANSLOCATING
NADH-QUINONE
REDUCTASE SUBUNIT F)		 4dia 2-PYRONE-4,6-DICARBA
XYLATE HYDROLASE
(Sphingomonas
paucimobilis) 		4 / 5 GLY A  55
ALA A  54
GLY A  36
PRO A  37
 None
 0.88A 4u9uA-4diaA:
undetectable		 4u9uA-4diaA:
17.95
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.
4U9U_B_ACTB1502_0
(NA(+)-TRANSLOCATING
NADH-QUINONE
REDUCTASE SUBUNIT F)		 4dia 2-PYRONE-4,6-DICARBA
XYLATE HYDROLASE
(Sphingomonas
paucimobilis) 		4 / 5 GLY A  55
ALA A  54
GLY A  36
PRO A  37
 None
 0.90A 4u9uB-4diaA:
undetectable		 4u9uB-4diaA:
17.95
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.
5GWK_F_EVPF102_1
(DNA TOPOISOMERASE
2-ALPHA)		 4dia 2-PYRONE-4,6-DICARBA
XYLATE HYDROLASE
(Sphingomonas
paucimobilis) 		4 / 5 GLY A 192
ASP A 191
ARG A 199
MET A 267
 None
 1.48A 5gwkA-4diaA:
undetectable		 5gwkA-4diaA:
16.25
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.
5H2U_A_1N1A501_2
(PROTEIN-TYROSINE
KINASE 6)		 4dia 2-PYRONE-4,6-DICARBA
XYLATE HYDROLASE
(Sphingomonas
paucimobilis) 		3 / 3 ILE A  73
MET A 287
ASP A  29
 None
 0.63A 5h2uA-4diaA:
undetectable		 5h2uA-4diaA:
21.52
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.
5I3B_B_HQEB303_1
(TYROSINASE)		 4dia 2-PYRONE-4,6-DICARBA
XYLATE HYDROLASE
(Sphingomonas
paucimobilis) 		4 / 5 HIS A  33
HIS A  31
VAL A  74
ALA A  76
 None
 1.28A 5i3bB-4diaA:
undetectable		 5i3bB-4diaA:
21.07
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.
6GTQ_A_ACTA204_0
(N-ACETYLTRANSFERASE)		 4dia 2-PYRONE-4,6-DICARBA
XYLATE HYDROLASE
(Sphingomonas
paucimobilis) 		4 / 5 THR A 247
CYH A 214
THR A 213
GLY A 246
 None
 1.18A 6gtqA-4diaA:
undetectable		 6gtqA-4diaA:
20.32