SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '4ccs'

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.
1EQH_A_FLPA701_1
(PROSTAGLANDIN H2
SYNTHASE-1)		 4ccs CBIX
(Paracoccus
pantotrophus) 		5 / 12 VAL A   8
LEU A  74
GLY A  48
ALA A  49
LEU A  44
 None
None
None
None
EDO  A1229 (-3.9A)
 1.03A 1eqhA-4ccsA:
undetectable		 1eqhA-4ccsA:
16.81
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.
1FBY_B_9CRB1500_1
(RETINOIC ACID
RECEPTOR RXR-ALPHA)		 4ccs CBIX
(Paracoccus
pantotrophus) 		5 / 12 ILE A 106
ALA A 109
ALA A 110
GLN A 113
LEU A 206
 None
 0.80A 1fbyB-4ccsA:
undetectable		 1fbyB-4ccsA:
20.77
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.
1RE7_B_FOLB361_0
(DIHYDROFOLATE
REDUCTASE)		 4ccs CBIX
(Paracoccus
pantotrophus) 		5 / 12 ALA A 182
PHE A  63
ILE A  59
LEU A  74
PRO A  75
 None
 0.95A 1re7B-4ccsA:
undetectable		 1re7B-4ccsA:
25.00
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.
2D0K_A_FOLA1161_0
(DIHYDROFOLATE
REDUCTASE)		 4ccs CBIX
(Paracoccus
pantotrophus) 		5 / 12 ALA A 182
PHE A  63
ILE A  59
LEU A  74
PRO A  75
 None
 0.82A 2d0kA-4ccsA:
undetectable		 2d0kA-4ccsA:
21.55
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.
2W8Y_A_486A1000_1
(PROGESTERONE
RECEPTOR)		 4ccs CBIX
(Paracoccus
pantotrophus) 		5 / 12 LEU A 206
LEU A 211
GLY A 210
ARG A  29
CYH A 102
 None
 1.19A 2w8yA-4ccsA:
undetectable		 2w8yA-4ccsA:
21.03
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.
3D9L_A_ACTA501_0
(CTD-PEPTIDE
RNA-BINDING PROTEIN
16)		 4ccs CBIX
(Paracoccus
pantotrophus) 		4 / 5 PRO A  90
ILE A  88
PRO A  61
TYR A  60
 None
 1.38A 3d9lA-4ccsA:
undetectable
3d9lY-4ccsA:
undetectable		 3d9lA-4ccsA:
12.78
3d9lY-4ccsA:
4.50
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.
3GWV_A_RFXA801_1
(TRANSPORTER)		 4ccs CBIX
(Paracoccus
pantotrophus) 		5 / 12 LEU A  98
GLY A  97
LEU A 101
ALA A 104
LEU A 146
 None
 0.99A 3gwvA-4ccsA:
undetectable		 3gwvA-4ccsA:
20.16
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.
3N8W_A_FLPA701_1
(PROSTAGLANDIN G/H
SYNTHASE 1)		 4ccs CBIX
(Paracoccus
pantotrophus) 		5 / 12 VAL A   8
LEU A  74
GLY A  48
ALA A  49
LEU A  44
 None
None
None
None
EDO  A1229 (-3.9A)
 1.05A 3n8wA-4ccsA:
undetectable		 3n8wA-4ccsA:
17.25
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.
3N8Z_A_FLPA701_1
(PROSTAGLANDIN G/H
SYNTHASE 1)		 4ccs CBIX
(Paracoccus
pantotrophus) 		5 / 12 VAL A   8
LEU A  74
GLY A  48
ALA A  49
LEU A  44
 None
None
None
None
EDO  A1229 (-3.9A)
 1.07A 3n8zA-4ccsA:
undetectable		 3n8zA-4ccsA:
17.25
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.
3SMT_A_ACTA1001_0
(HISTONE-LYSINE
N-METHYLTRANSFERASE
SETD3)		 4ccs CBIX
(Paracoccus
pantotrophus) 		4 / 5 LEU A  44
GLY A  11
PHE A  69
ARG A  77
 EDO  A1229 (-3.9A)
EDO  A1229 (-3.2A)
EDO  A1229 ( 4.8A)
EDO  A1229 ( 4.0A)
 0.60A 3smtA-4ccsA:
undetectable		 3smtA-4ccsA:
16.73
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.
4FN9_A_STRA301_1
(STEROID RECEPTOR 2)		 4ccs CBIX
(Paracoccus
pantotrophus) 		5 / 12 LEU A 206
LEU A 178
LEU A 180
ALA A 125
ALA A 153
 None
 1.09A 4fn9A-4ccsA:
undetectable		 4fn9A-4ccsA:
23.02
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.
4KJJ_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)		 4ccs CBIX
(Paracoccus
pantotrophus) 		5 / 12 ALA A 182
ALA A  65
PHE A  63
ILE A  59
LEU A  74
 None
 1.03A 4kjjA-4ccsA:
undetectable		 4kjjA-4ccsA:
25.00
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.
4LVC_B_ADNB501_2
(S-ADENOSYL-L-HOMOCYS
TEINE HYDROLASE
(SAHASE))		 4ccs CBIX
(Paracoccus
pantotrophus) 		4 / 5 GLN A 113
THR A 112
LEU A 178
LEU A 206
 None
 1.07A 4lvcB-4ccsA:
undetectable		 4lvcB-4ccsA:
20.46
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.
4P3Q_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)		 4ccs CBIX
(Paracoccus
pantotrophus) 		5 / 12 ALA A 182
PHE A  63
ILE A  59
LEU A  74
PRO A  75
 None
 1.04A 4p3qA-4ccsA:
undetectable		 4p3qA-4ccsA:
25.00
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.
4PH9_A_IBPA601_1
(PROSTAGLANDIN G/H
SYNTHASE 2)		 4ccs CBIX
(Paracoccus
pantotrophus) 		5 / 10 VAL A   8
LEU A  74
GLY A  48
ALA A  49
LEU A  44
 None
None
None
None
EDO  A1229 (-3.9A)
 1.09A 4ph9A-4ccsA:
undetectable		 4ph9A-4ccsA:
17.34
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.
4PH9_B_IBPB601_1
(PROSTAGLANDIN G/H
SYNTHASE 2)		 4ccs CBIX
(Paracoccus
pantotrophus) 		5 / 10 VAL A   8
LEU A  74
GLY A  48
ALA A  49
LEU A  44
 None
None
None
None
EDO  A1229 (-3.9A)
 1.08A 4ph9B-4ccsA:
undetectable		 4ph9B-4ccsA:
17.34
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.
4PSY_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)		 4ccs CBIX
(Paracoccus
pantotrophus) 		5 / 12 ALA A 182
ALA A  65
PHE A  63
ILE A  59
LEU A  74
 None
 1.06A 4psyA-4ccsA:
undetectable		 4psyA-4ccsA:
25.00
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.
5D75_A_FK5A301_1
(PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE
FKBP3)		 4ccs CBIX
(Paracoccus
pantotrophus) 		5 / 11 LEU A  78
VAL A   8
ILE A   7
ALA A 226
ILE A 223
 None
 1.13A 5d75A-4ccsA:
undetectable		 5d75A-4ccsA:
18.26
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.
5M5K_B_ADNB502_2
(ADENOSYLHOMOCYSTEINA
SE)		 4ccs CBIX
(Paracoccus
pantotrophus) 		4 / 4 GLN A 113
THR A 112
LEU A 178
LEU A 206
 None
 1.09A 5m5kB-4ccsA:
undetectable		 5m5kB-4ccsA:
20.46
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.
6EMU_A_SAMA501_0
(TRNA
(GUANINE(9)-/ADENINE
(9)-N1)-METHYLTRANSF
ERASE)		 4ccs CBIX
(Paracoccus
pantotrophus) 		5 / 12 LEU A  62
PRO A  61
GLY A  93
THR A  66
ILE A   7
 None
 1.01A 6emuA-4ccsA:
undetectable		 6emuA-4ccsA:
19.29