SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '4jj6'

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.
1BRP_A_RTLA183_0
(RETINOL BINDING
PROTEIN)		 4jj6 ACETYL XYLAN
ESTERASE
(Geobacillus
stearothermophil
us) 		5 / 12 LEU A  44
PHE A  11
ALA A 204
MET A 201
GLY A  36
 None
None
None
None
GOL  A 304 (-3.7A)
 1.32A 1brpA-4jj6A:
undetectable		 1brpA-4jj6A:
24.24
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.
1D8C_A_SORA4000_0
(MALATE SYNTHASE G)		 4jj6 ACETYL XYLAN
ESTERASE
(Geobacillus
stearothermophil
us) 		3 / 3 GLN A  97
HIS A 107
PRO A 101
 None
 0.88A 1d8cA-4jj6A:
undetectable		 1d8cA-4jj6A:
14.84
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.
1YAJ_G_BEZG3385_0
(CES1 PROTEIN)		 4jj6 ACETYL XYLAN
ESTERASE
(Geobacillus
stearothermophil
us) 		3 / 3 SER A  86
VAL A  56
LEU A   9
 None
 0.71A 1yajG-4jj6A:
2.3		 1yajG-4jj6A:
18.60
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.
2HMY_B_SAMB328_0
(PROTEIN
(CYTOSINE-SPECIFIC
METHYLTRANSFERASE
HHAI))		 4jj6 ACETYL XYLAN
ESTERASE
(Geobacillus
stearothermophil
us) 		5 / 12 GLY A  60
GLY A  26
ASP A  14
LEU A 120
VAL A  57
 None
None
CL  A 305 ( 4.4A)
None
None
 1.00A 2hmyB-4jj6A:
3.6		 2hmyB-4jj6A:
22.39
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.
2OXT_A_SAMA300_0
(NUCLEOSIDE-2'-O-METH
YLTRANSFERASE)		 4jj6 ACETYL XYLAN
ESTERASE
(Geobacillus
stearothermophil
us) 		5 / 12 GLY A 130
GLY A   4
ILE A 131
ASP A  83
VAL A 128
 None
 0.93A 2oxtA-4jj6A:
2.9		 2oxtA-4jj6A:
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.
2OXT_C_SAMC300_0
(NUCLEOSIDE-2'-O-METH
YLTRANSFERASE)		 4jj6 ACETYL XYLAN
ESTERASE
(Geobacillus
stearothermophil
us) 		5 / 12 GLY A 130
GLY A   4
ILE A 131
ASP A  83
VAL A 128
 None
 0.93A 2oxtC-4jj6A:
3.1		 2oxtC-4jj6A:
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.
3AF0_A_PAUA314_0
(PANTOTHENATE KINASE)		 4jj6 ACETYL XYLAN
ESTERASE
(Geobacillus
stearothermophil
us) 		4 / 8 ASP A  68
LEU A  69
GLY A  13
TYR A 113
 None
 0.95A 3af0A-4jj6A:
undetectable		 3af0A-4jj6A:
23.48
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)		 4jj6 ACETYL XYLAN
ESTERASE
(Geobacillus
stearothermophil
us) 		5 / 11 THR A 124
VAL A 128
LEU A   9
VAL A  57
PHE A 207
 None
 1.22A 3tbgA-4jj6A:
undetectable		 3tbgA-4jj6A:
18.95
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.
3TBG_C_RTZC2_1
(CYTOCHROME P450 2D6)		 4jj6 ACETYL XYLAN
ESTERASE
(Geobacillus
stearothermophil
us) 		5 / 10 THR A 124
VAL A 128
LEU A   9
VAL A  57
PHE A 207
 None
 1.19A 3tbgC-4jj6A:
undetectable		 3tbgC-4jj6A:
18.95
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.
3ZMD_A_SALA201_1
(PUTATIVE
TRANSCRIPTIONAL
REGULATOR)		 4jj6 ACETYL XYLAN
ESTERASE
(Geobacillus
stearothermophil
us) 		4 / 8 ARG A  67
TYR A 109
GLU A 112
HIS A 107
 None
GOL  A 302 (-4.5A)
None
None
 1.42A 3zmdA-4jj6A:
undetectable
3zmdB-4jj6A:
undetectable		 3zmdA-4jj6A:
22.84
3zmdB-4jj6A:
22.84
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.
4I41_A_MIXA500_2
(SERINE/THREONINE-PRO
TEIN KINASE PIM-1)		 4jj6 ACETYL XYLAN
ESTERASE
(Geobacillus
stearothermophil
us) 		4 / 4 LEU A  69
LEU A 133
GLN A  80
GLU A 123
 None
 1.27A 4i41A-4jj6A:
undetectable		 4i41A-4jj6A:
23.96
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.
5TIX_B_OQRB302_0
(SULFOTRANSFERASE)		 4jj6 ACETYL XYLAN
ESTERASE
(Geobacillus
stearothermophil
us) 		5 / 10 PRO A  82
ILE A 132
VAL A 128
LEU A 127
GLU A 123
 None
 1.41A 5tixB-4jj6A:
2.6		 5tixB-4jj6A:
22.94
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.
5TRQ_B_ACTB306_0
(WELO5)		 4jj6 ACETYL XYLAN
ESTERASE
(Geobacillus
stearothermophil
us) 		3 / 3 GLU A 140
ARG A 192
TYR A 138
 None
 0.64A 5trqB-4jj6A:
undetectable		 5trqB-4jj6A:
22.55