SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3ddj'

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.
1PWY_E_AC2E290_1
(PURINE NUCLEOSIDE
PHOSPHORYLASE)		 3ddj CBS
DOMAIN-CONTAINING
PROTEIN
(Sulfolobus
solfataricus) 		5 / 10 VAL A 173
GLY A 182
THR A 185
ASN A 188
VAL A 210
 None
 1.27A 1pwyE-3ddjA:
undetectable		 1pwyE-3ddjA:
23.49
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.
1XOZ_A_CIAA501_1
(CGMP-SPECIFIC
3',5'-CYCLIC
PHOSPHODIESTERASE)		 3ddj CBS
DOMAIN-CONTAINING
PROTEIN
(Sulfolobus
solfataricus) 		5 / 12 ALA A  96
ILE A  99
ILE A   3
LEU A  45
ILE A  42
 None
None
None
PEG  A 279 (-4.9A)
None
 1.14A 1xozA-3ddjA:
undetectable		 1xozA-3ddjA:
23.71
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.
2OUZ_A_C3DA999_1
(ESTROGEN RECEPTOR)		 3ddj CBS
DOMAIN-CONTAINING
PROTEIN
(Sulfolobus
solfataricus) 		4 / 6 ASP A 259
GLU A 123
ARG A  34
MET A 163
 AMP  A 278 (-2.7A)
AMP  A 278 ( 4.8A)
PEG  A 279 (-4.1A)
None
 1.31A 2ouzA-3ddjA:
undetectable		 2ouzA-3ddjA:
19.05
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.
3KPB_A_SAMA1000_0
(UNCHARACTERIZED
PROTEIN MJ0100)		 3ddj CBS
DOMAIN-CONTAINING
PROTEIN
(Sulfolobus
solfataricus) 		5 / 12 ILE A 254
THR A 256
ASP A 259
VAL A 147
PRO A 172
 AMP  A 278 ( 4.5A)
AMP  A 278 (-3.1A)
AMP  A 278 (-2.7A)
AMP  A 278 ( 3.6A)
AMP  A 278 (-4.7A)
 0.49A 3kpbA-3ddjA:
12.6		 3kpbA-3ddjA:
17.75
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.
3KPB_C_SAMC1000_0
(UNCHARACTERIZED
PROTEIN MJ0100)		 3ddj CBS
DOMAIN-CONTAINING
PROTEIN
(Sulfolobus
solfataricus) 		5 / 12 ILE A 254
THR A 256
ASP A 259
VAL A 147
PRO A 172
 AMP  A 278 ( 4.5A)
AMP  A 278 (-3.1A)
AMP  A 278 (-2.7A)
AMP  A 278 ( 3.6A)
AMP  A 278 (-4.7A)
 0.48A 3kpbC-3ddjA:
12.1		 3kpbC-3ddjA:
17.75
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.
3KPC_A_SAMA1000_0
(UNCHARACTERIZED
PROTEIN MJ0100)		 3ddj CBS
DOMAIN-CONTAINING
PROTEIN
(Sulfolobus
solfataricus) 		5 / 11 ILE A 254
THR A 256
ASP A 259
VAL A 147
PRO A 172
 AMP  A 278 ( 4.5A)
AMP  A 278 (-3.1A)
AMP  A 278 (-2.7A)
AMP  A 278 ( 3.6A)
AMP  A 278 (-4.7A)
 0.30A 3kpcA-3ddjA:
13.6		 3kpcA-3ddjA:
16.72
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.
3KPC_A_SAMA1000_0
(UNCHARACTERIZED
PROTEIN MJ0100)		 3ddj CBS
DOMAIN-CONTAINING
PROTEIN
(Sulfolobus
solfataricus) 		5 / 11 THR A  47
ASP A  50
THR A  81
ASN A 104
PRO A 109
 PEG  A 279 (-4.4A)
None
None
None
None
 0.88A 3kpcA-3ddjA:
13.6		 3kpcA-3ddjA:
16.72
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.
3KPD_B_SAMB1000_0
(UNCHARACTERIZED
PROTEIN MJ0100)		 3ddj CBS
DOMAIN-CONTAINING
PROTEIN
(Sulfolobus
solfataricus) 		5 / 12 ILE A 254
THR A 256
ASP A 259
VAL A 147
PRO A 172
 AMP  A 278 ( 4.5A)
AMP  A 278 (-3.1A)
AMP  A 278 (-2.7A)
AMP  A 278 ( 3.6A)
AMP  A 278 (-4.7A)
 0.33A 3kpdB-3ddjA:
12.6		 3kpdB-3ddjA:
17.75
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.
3KPD_B_SAMB1000_0
(UNCHARACTERIZED
PROTEIN MJ0100)		 3ddj CBS
DOMAIN-CONTAINING
PROTEIN
(Sulfolobus
solfataricus) 		5 / 12 THR A  47
ASP A  50
THR A  81
ASN A 104
PRO A 109
 PEG  A 279 (-4.4A)
None
None
None
None
 0.78A 3kpdB-3ddjA:
12.6		 3kpdB-3ddjA:
17.75
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.
3KPD_C_SAMC1000_1
(UNCHARACTERIZED
PROTEIN MJ0100)		 3ddj CBS
DOMAIN-CONTAINING
PROTEIN
(Sulfolobus
solfataricus) 		5 / 12 ILE A 254
THR A 256
ASP A 259
VAL A 147
PRO A 172
 AMP  A 278 ( 4.5A)
AMP  A 278 (-3.1A)
AMP  A 278 (-2.7A)
AMP  A 278 ( 3.6A)
AMP  A 278 (-4.7A)
 0.33A 3kpdC-3ddjA:
12.8		 3kpdC-3ddjA:
17.75
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.
3KPD_C_SAMC1000_1
(UNCHARACTERIZED
PROTEIN MJ0100)		 3ddj CBS
DOMAIN-CONTAINING
PROTEIN
(Sulfolobus
solfataricus) 		5 / 12 THR A  47
ASP A  50
THR A  81
ASN A 104
PRO A 109
 PEG  A 279 (-4.4A)
None
None
None
None
 0.90A 3kpdC-3ddjA:
12.8		 3kpdC-3ddjA:
17.75
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.
3NXU_A_RITA600_1
(CYTOCHROME P450 3A4)		 3ddj CBS
DOMAIN-CONTAINING
PROTEIN
(Sulfolobus
solfataricus) 		5 / 12 ILE A  42
ILE A  99
ALA A  96
GLU A 125
GLY A 106
 None
None
None
None
PEG  A 279 (-3.9A)
 1.02A 3nxuA-3ddjA:
undetectable		 3nxuA-3ddjA:
24.68
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.
3ZNC_A_BZ1A500_1
(CARBONIC ANHYDRASE
IV)		 3ddj CBS
DOMAIN-CONTAINING
PROTEIN
(Sulfolobus
solfataricus) 		5 / 10 VAL A 197
PHE A  24
LEU A  20
THR A  73
THR A  74
 None
 1.42A 3zncA-3ddjA:
undetectable		 3zncA-3ddjA:
24.93
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.
4FGL_D_CLQD303_0
(RIBOSYLDIHYDRONICOTI
NAMIDE DEHYDROGENASE
[QUINONE])		 3ddj CBS
DOMAIN-CONTAINING
PROTEIN
(Sulfolobus
solfataricus) 		4 / 7 GLY A 119
VAL A 118
ILE A   3
PHE A 126
 None
 0.89A 4fglC-3ddjA:
undetectable		 4fglC-3ddjA:
22.83
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.
4JEC_B_478B401_3
(HIV-1 PROTEASE)		 3ddj CBS
DOMAIN-CONTAINING
PROTEIN
(Sulfolobus
solfataricus) 		3 / 3 ASP A  92
LEU A   6
VAL A 118
 None
 0.66A 4jecB-3ddjA:
undetectable		 4jecB-3ddjA:
18.56
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.
4PCU_A_SAMA603_0
(CYSTATHIONINE
BETA-SYNTHASE)		 3ddj CBS
DOMAIN-CONTAINING
PROTEIN
(Sulfolobus
solfataricus) 		4 / 7 PHE A 168
PRO A 172
THR A 256
ASP A 259
 AMP  A 278 (-3.5A)
AMP  A 278 (-4.7A)
AMP  A 278 (-3.1A)
AMP  A 278 (-2.7A)
 0.83A 4pcuA-3ddjA:
10.7		 4pcuA-3ddjA:
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.
4Y0Q_A_PX9A201_0
(BETA-LACTOGLOBULIN)		 3ddj CBS
DOMAIN-CONTAINING
PROTEIN
(Sulfolobus
solfataricus) 		5 / 12 ILE A  36
LYS A  16
GLU A  17
VAL A 111
VAL A  87
 None
 1.03A 4y0qA-3ddjA:
undetectable		 4y0qA-3ddjA:
19.49
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.
5D0Y_A_FOLA201_1
(CONSERVED
HYPOTHETICAL
MEMBRANE PROTEIN)		 3ddj CBS
DOMAIN-CONTAINING
PROTEIN
(Sulfolobus
solfataricus) 		3 / 3 ARG A 252
LYS A 140
GLU A 223
 None
 0.79A 5d0yA-3ddjA:
undetectable		 5d0yA-3ddjA:
20.88
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.
6BRD_A_RFPA502_2
(RIFAMPIN
MONOOXYGENASE)		 3ddj CBS
DOMAIN-CONTAINING
PROTEIN
(Sulfolobus
solfataricus) 		4 / 4 GLN A 148
VAL A 173
ARG A 258
ARG A 166
 None
 1.10A 6brdA-3ddjA:
undetectable		 6brdA-3ddjA:
16.36
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.
6F7L_B_ACTB503_0
(AMINE OXIDASE LKCE)		 3ddj CBS
DOMAIN-CONTAINING
PROTEIN
(Sulfolobus
solfataricus) 		3 / 3 VAL A 121
GLU A 125
ILE A   3
 None
 0.65A 6f7lB-3ddjA:
undetectable		 6f7lB-3ddjA:
20.31