SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '1xkg'

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.
1D4S_A_TPVA201_2
(PROTEIN (HIV-1
PROTEASE))		 1xkg MAJOR MITE FECAL
ALLERGEN DER P 1
(Dermatophagoides
pteronyssinus) 		5 / 8 LEU A 128
ALA A 217
GLY A 256
ILE A  94
VAL A 102
 None
 1.34A 1d4sB-1xkgA:
undetectable		 1d4sB-1xkgA:
14.01
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.
1ERR_B_CCSB381_0
(ESTROGEN RECEPTOR)		 1xkg MAJOR MITE FECAL
ALLERGEN DER P 1
(Dermatophagoides
pteronyssinus) 		3 / 3 GLU A 124
ALA A 126
SER A 216
 None
 0.61A 1errB-1xkgA:
undetectable		 1errB-1xkgA:
20.18
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.
1KQW_A_RTLA135_0
(CELLULAR
RETINOL-BINDING
PROTEIN)		 1xkg MAJOR MITE FECAL
ALLERGEN DER P 1
(Dermatophagoides
pteronyssinus) 		5 / 12 ILE A 156
THR A 101
VAL A 102
LEU A 211
ILE A 254
 None
 1.28A 1kqwA-1xkgA:
undetectable		 1kqwA-1xkgA:
15.06
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.
1STF_E_CCSE25_0
(PAPAIN
STEFIN B (CYSTATIN
B))		 1xkg MAJOR MITE FECAL
ALLERGEN DER P 1
(Dermatophagoides
pteronyssinus) 		7 / 10 GLN A 108
GLY A 112
SER A 113
PHE A 117
SER A 118
ALA A 251
GLY A 153
 None
GOL  A 602 ( 4.9A)
None
SO4  A 501 (-4.7A)
None
GOL  A 602 (-3.9A)
GOL  A 602 (-3.4A)
 1.21A 1stfE-1xkgA:
28.4
1stfI-1xkgA:
undetectable		 1stfE-1xkgA:
23.60
1stfI-1xkgA:
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.
1STF_E_CCSE25_0
(PAPAIN
STEFIN B (CYSTATIN
B))		 1xkg MAJOR MITE FECAL
ALLERGEN DER P 1
(Dermatophagoides
pteronyssinus) 		8 / 10 GLN A 108
GLY A 112
SER A 113
TRP A 115
PHE A 117
SER A 118
HIS A 250
ALA A 251
 None
GOL  A 602 ( 4.9A)
None
None
SO4  A 501 (-4.7A)
None
None
GOL  A 602 (-3.9A)
 0.52A 1stfE-1xkgA:
28.4
1stfI-1xkgA:
undetectable		 1stfE-1xkgA:
23.60
1stfI-1xkgA:
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.
3AI8_A_HNQA255_1
(CATHEPSIN B)		 1xkg MAJOR MITE FECAL
ALLERGEN DER P 1
(Dermatophagoides
pteronyssinus) 		4 / 7 GLN A 108
GLY A 112
HIS A 250
TRP A 272
 None
GOL  A 602 ( 4.9A)
None
None
 0.38A 3ai8A-1xkgA:
26.9		 3ai8A-1xkgA:
23.05
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.
3FRQ_B_ERYB195_1
(REPRESSOR PROTEIN
MPHR(A))		 1xkg MAJOR MITE FECAL
ALLERGEN DER P 1
(Dermatophagoides
pteronyssinus) 		4 / 7 TYR A 176
ASN A 270
HIS A 250
ALA A 114
 None
None
None
GOL  A 602 (-3.9A)
 1.18A 3frqB-1xkgA:
undetectable		 3frqB-1xkgA:
22.15
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.
3NU4_B_478B401_1
(PROTEASE)		 1xkg MAJOR MITE FECAL
ALLERGEN DER P 1
(Dermatophagoides
pteronyssinus) 		5 / 9 ILE A 222
GLY A 282
ILE A 267
VAL A 220
ILE A 293
 None
 1.03A 3nu4A-1xkgA:
undetectable		 3nu4A-1xkgA:
14.66
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.
3S43_A_478A401_2
(PROTEASE)		 1xkg MAJOR MITE FECAL
ALLERGEN DER P 1
(Dermatophagoides
pteronyssinus) 		5 / 10 ALA A 219
ILE A 160
VAL A 300
ILE A 199
ILE A 156
 None
 1.02A 3s43B-1xkgA:
undetectable		 3s43B-1xkgA:
14.33
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.
3T7V_A_SAMA992_0
(METHYLORNITHINE
SYNTHASE PYLB)		 1xkg MAJOR MITE FECAL
ALLERGEN DER P 1
(Dermatophagoides
pteronyssinus) 		5 / 12 GLY A 282
GLY A 277
LEU A  62
VAL A 252
ALA A 251
 None
None
None
None
GOL  A 602 (-3.9A)
 0.96A 3t7vA-1xkgA:
undetectable		 3t7vA-1xkgA:
21.93
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.
3TBG_A_RTZA2_1
(CYTOCHROME P450 2D6)		 1xkg MAJOR MITE FECAL
ALLERGEN DER P 1
(Dermatophagoides
pteronyssinus) 		5 / 11 LEU A 137
SER A 118
GLU A 139
VAL A 102
THR A 103
 None
None
YT3  A 401 (-2.8A)
None
None
 1.17A 3tbgA-1xkgA:
undetectable		 3tbgA-1xkgA:
18.79
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.
4ZBQ_A_DIFA602_1
(SERUM ALBUMIN)		 1xkg MAJOR MITE FECAL
ALLERGEN DER P 1
(Dermatophagoides
pteronyssinus) 		4 / 8 LEU A 211
ASN A 253
VAL A 268
GLU A 294
 None
 0.86A 4zbqA-1xkgA:
undetectable		 4zbqA-1xkgA:
17.35
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.
5EUM_B_ACTB603_0
(LIPID A EXPORT
ATP-BINDING/PERMEASE
PROTEIN MSBA)		 1xkg MAJOR MITE FECAL
ALLERGEN DER P 1
(Dermatophagoides
pteronyssinus) 		4 / 4 ALA A 204
ASN A 203
ARG A 208
ILE A 207
 None
 1.31A 5eumB-1xkgA:
0.0		 5eumB-1xkgA:
23.15
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.
5GWZ_D_010D6_0
(N-[(5-METHYLISOXAZOL
-3-YL)CARBONYL]ALANY
L-L-VALYL-N~1~-((1R,
2Z)-4-(BENZYLOXY)-4-
OXO-1-{[(3R)-2-OXOPY
RROLIDIN-3-YL]METHYL
}BUT-2-ENYL)-L-LEUCI
NAMIDE
PEDV MAIN PROTEASE)		 1xkg MAJOR MITE FECAL
ALLERGEN DER P 1
(Dermatophagoides
pteronyssinus) 		3 / 3 MET A 107
HIS A  48
GLY A 280
 None
 0.85A 5gwzB-1xkgA:
undetectable		 5gwzB-1xkgA:
21.65
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.
5KKZ_E_ASCE1004_0
(CYTOCHROME B
UBIQUINOL-CYTOCHROME
C REDUCTASE
IRON-SULFUR SUBUNIT)		 1xkg MAJOR MITE FECAL
ALLERGEN DER P 1
(Dermatophagoides
pteronyssinus) 		4 / 7 HIS A 250
ILE A 221
VAL A 220
TYR A 298
 None
 1.28A 5kkzC-1xkgA:
undetectable
5kkzE-1xkgA:
undetectable		 5kkzC-1xkgA:
19.75
5kkzE-1xkgA:
17.78
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.
6DWD_C_GLYC713_0
(DEOXYNUCLEOSIDE
TRIPHOSPHATE
TRIPHOSPHOHYDROLASE
SAMHD1)		 1xkg MAJOR MITE FECAL
ALLERGEN DER P 1
(Dermatophagoides
pteronyssinus) 		3 / 3 GLN A 164
TYR A 196
ASN A 195
 None
 0.56A 6dwdC-1xkgA:
undetectable		 6dwdC-1xkgA:
17.93
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.
6EU9_B_REAB601_1
(RETINOIC ACID
RECEPTOR)		 1xkg MAJOR MITE FECAL
ALLERGEN DER P 1
(Dermatophagoides
pteronyssinus) 		5 / 10 VAL A 102
LEU A 128
SER A 125
LEU A 211
GLY A 256
 None
 1.17A 6eu9B-1xkgA:
undetectable		 6eu9B-1xkgA:
13.62