SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '5bp3'

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.
1A4L_D_DCFD1853_2
(ADENOSINE DEAMINASE)		 5bp3 MYCOCEROSIC ACID
SYNTHASE-LIKE
POLYKETIDE SYNTHASE
(Mycolicibacteriu
m
smegmatis) 		4 / 4 HIS A 901
LEU A 942
LEU A 931
LEU A1085
 None
 0.99A 1a4lD-5bp3A:
undetectable		 1a4lD-5bp3A:
23.82
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.
1EA1_A_TPFA470_1
(CYTOCHROME P450
51-LIKE RV0764C)		 5bp3 MYCOCEROSIC ACID
SYNTHASE-LIKE
POLYKETIDE SYNTHASE
(Mycolicibacteriu
m
smegmatis) 		4 / 8 TYR A 947
MET A 950
THR A 980
LEU A 974
 None
 1.31A 1ea1A-5bp3A:
undetectable		 1ea1A-5bp3A:
21.98
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.
1T88_A_CAMA1422_0
(CYTOCHROME P450-CAM)		 5bp3 MYCOCEROSIC ACID
SYNTHASE-LIKE
POLYKETIDE SYNTHASE
(Mycolicibacteriu
m
smegmatis) 		4 / 7 LEU A1172
VAL A1125
GLY A1124
ASP A1100
 None
 0.95A 1t88A-5bp3A:
undetectable		 1t88A-5bp3A:
20.00
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.
1TH6_A_OINA401_1
(PHOSPHOLIPASE A2)		 5bp3 MYCOCEROSIC ACID
SYNTHASE-LIKE
POLYKETIDE SYNTHASE
(Mycolicibacteriu
m
smegmatis) 		4 / 7 GLY A 905
TRP A 919
HIS A 928
PRO A1096
 None
 1.16A 1th6A-5bp3A:
undetectable		 1th6A-5bp3A:
15.08
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_1
(NUCLEOSIDE-2'-O-METH
YLTRANSFERASE)		 5bp3 MYCOCEROSIC ACID
SYNTHASE-LIKE
POLYKETIDE SYNTHASE
(Mycolicibacteriu
m
smegmatis) 		4 / 4 SER A 985
GLY A 997
HIS A1001
ASP A 977
 None
 1.21A 2oxtC-5bp3A:
undetectable		 2oxtC-5bp3A:
24.38
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.
2XKW_B_P1BB1475_1
(PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA)		 5bp3 MYCOCEROSIC ACID
SYNTHASE-LIKE
POLYKETIDE SYNTHASE
(Mycolicibacteriu
m
smegmatis) 		5 / 12 PHE A1059
HIS A1055
SER A1105
ALA A1077
LEU A1156
 None
 1.26A 2xkwB-5bp3A:
undetectable		 2xkwB-5bp3A:
22.36
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.
3B0W_A_DGXA1_2
(NUCLEAR RECEPTOR
ROR-GAMMA)		 5bp3 MYCOCEROSIC ACID
SYNTHASE-LIKE
POLYKETIDE SYNTHASE
(Mycolicibacteriu
m
smegmatis) 		3 / 3 TRP A 930
VAL A 998
ARG A1006
 None
 0.86A 3b0wA-5bp3A:
undetectable		 3b0wA-5bp3A:
20.13
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.
3LS4_H_TCIH220_1
(HEAVY CHAIN OF
ANTIBODY FAB
FRAGMENT)		 5bp3 MYCOCEROSIC ACID
SYNTHASE-LIKE
POLYKETIDE SYNTHASE
(Mycolicibacteriu
m
smegmatis) 		5 / 10 VAL A 982
VAL A 984
TYR A 947
GLY A 921
GLY A 905
 None
 0.81A 3ls4H-5bp3A:
undetectable		 3ls4H-5bp3A:
21.31
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.
3R2J_B_NIOB311_1
(ALPHA/BETA-HYDROLASE
-LIKE PROTEIN)		 5bp3 MYCOCEROSIC ACID
SYNTHASE-LIKE
POLYKETIDE SYNTHASE
(Mycolicibacteriu
m
smegmatis) 		5 / 11 LEU A 931
TRP A 930
HIS A 928
TYR A1092
ALA A 946
 None
 1.47A 3r2jB-5bp3A:
undetectable		 3r2jB-5bp3A:
22.33
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.
3T01_A_PPFA503_1
(PHOSPHONOACETATE
HYDROLASE)		 5bp3 MYCOCEROSIC ACID
SYNTHASE-LIKE
POLYKETIDE SYNTHASE
(Mycolicibacteriu
m
smegmatis) 		4 / 7 ASP A1100
HIS A 934
ILE A1053
HIS A1055
 None
EDO  A1202 (-4.3A)
None
None
 1.05A 3t01A-5bp3A:
undetectable		 3t01A-5bp3A:
23.13
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.
4AE1_A_NCAA1536_0
(DIPHTHERIA TOXIN)		 5bp3 MYCOCEROSIC ACID
SYNTHASE-LIKE
POLYKETIDE SYNTHASE
(Mycolicibacteriu
m
smegmatis) 		4 / 6 GLY A1132
ALA A1130
TYR A1131
GLU A1157
 None
 0.90A 4ae1A-5bp3A:
undetectable		 4ae1A-5bp3A:
undetectable
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.
4IIZ_A_LURA201_1
(TRANSTHYRETIN)		 5bp3 MYCOCEROSIC ACID
SYNTHASE-LIKE
POLYKETIDE SYNTHASE
(Mycolicibacteriu
m
smegmatis) 		3 / 3 LYS A1181
LEU A 975
ALA A1182
 None
 0.84A 4iizA-5bp3A:
undetectable		 4iizA-5bp3A:
19.00
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.
4V04_B_0LIB1771_2
(FIBROBLAST GROWTH
FACTOR RECEPTOR 1
(FMS-RELATED
TYROSINE KINASE 2,
PFEIFFER SYNDROME),
ISOFORM CRA_B)		 5bp3 MYCOCEROSIC ACID
SYNTHASE-LIKE
POLYKETIDE SYNTHASE
(Mycolicibacteriu
m
smegmatis) 		6 / 12 VAL A1094
LEU A 931
HIS A 934
ALA A 945
ASP A1100
PHE A1103
 None
None
EDO  A1202 (-4.3A)
None
None
None
 1.06A 4v04B-5bp3A:
undetectable		 4v04B-5bp3A:
23.81
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.
4YB6_A_HISA302_0
(ATP
PHOSPHORIBOSYLTRANSF
ERASE)		 5bp3 MYCOCEROSIC ACID
SYNTHASE-LIKE
POLYKETIDE SYNTHASE
(Mycolicibacteriu
m
smegmatis) 		5 / 10 GLY A 997
VAL A 998
VAL A 984
LEU A 968
LEU A 904
 None
 1.26A 4yb6A-5bp3A:
undetectable
4yb6E-5bp3A:
undetectable		 4yb6A-5bp3A:
21.79
4yb6E-5bp3A:
21.79
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.
4YB6_B_HISB302_0
(ATP
PHOSPHORIBOSYLTRANSF
ERASE)		 5bp3 MYCOCEROSIC ACID
SYNTHASE-LIKE
POLYKETIDE SYNTHASE
(Mycolicibacteriu
m
smegmatis) 		5 / 10 GLY A 997
VAL A 998
VAL A 984
LEU A 968
LEU A 904
 None
 1.29A 4yb6B-5bp3A:
undetectable
4yb6C-5bp3A:
undetectable		 4yb6B-5bp3A:
21.79
4yb6C-5bp3A:
21.79
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.
4YB6_F_HISF302_0
(ATP
PHOSPHORIBOSYLTRANSF
ERASE)		 5bp3 MYCOCEROSIC ACID
SYNTHASE-LIKE
POLYKETIDE SYNTHASE
(Mycolicibacteriu
m
smegmatis) 		5 / 10 LEU A 968
LEU A 904
GLY A 997
VAL A 998
VAL A 984
 None
 1.27A 4yb6B-5bp3A:
undetectable
4yb6F-5bp3A:
undetectable		 4yb6B-5bp3A:
21.79
4yb6F-5bp3A:
21.79
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.
5MWY_A_YNUA1101_1
(MINERALOCORTICOID
RECEPTOR)		 5bp3 MYCOCEROSIC ACID
SYNTHASE-LIKE
POLYKETIDE SYNTHASE
(Mycolicibacteriu
m
smegmatis) 		4 / 6 GLN A1104
PHE A1059
CYH A 948
PHE A 970
 None
None
None
EDO  A1202 ( 4.5A)
 1.32A 5mwyA-5bp3A:
undetectable		 5mwyA-5bp3A:
20.41
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.
5XOO_B_ADNB503_1
(GLYCOSAMINOGLYCAN
XYLOSYLKINASE)		 5bp3 MYCOCEROSIC ACID
SYNTHASE-LIKE
POLYKETIDE SYNTHASE
(Mycolicibacteriu
m
smegmatis) 		4 / 5 LEU A1167
VAL A1094
GLU A 949
LEU A 952
 None
 1.12A 5xooB-5bp3A:
undetectable		 5xooB-5bp3A:
11.97
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.
6CJK_C_ACTC301_0
(IMMUNOGLOBULIN FAB
LIGHT CHAIN)		 5bp3 MYCOCEROSIC ACID
SYNTHASE-LIKE
POLYKETIDE SYNTHASE
(Mycolicibacteriu
m
smegmatis) 		4 / 4 VAL A 955
GLY A 963
ASP A 961
ASP A1017
 None
 1.43A 6cjkC-5bp3A:
undetectable		 6cjkC-5bp3A:
18.97