SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3o90'

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.
2WEK_A_DIFA1375_1
(ZINC-BINDING ALCOHOL
DEHYDROGENASE
DOMAIN-CONTAINING
PROTEIN 2)		 3o90 NICOTINAMIDASE
(Streptococcus
pneumoniae) 		3 / 3 LEU A  81
TYR A  89
GLN A  90
 None
 0.69A 2wekA-3o90A:
5.2		 2wekA-3o90A:
21.31
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2WT9_A_NIOA1216_1
(NICOTINAMIDASE)		 3o90 NICOTINAMIDASE
(Streptococcus
pneumoniae) 		7 / 10 ASP A   9
PHE A  14
LEU A  21
ASP A  53
HIS A  71
TYR A 106
CYH A 136
 None
None
None
ZN  A 192 (-2.3A)
ZN  A 192 (-3.2A)
None
None
 0.59A 2wt9A-3o90A:
22.0		 2wt9A-3o90A:
32.39
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2WT9_A_NIOA1216_1
(NICOTINAMIDASE)		 3o90 NICOTINAMIDASE
(Streptococcus
pneumoniae) 		5 / 10 PHE A  14
LEU A  21
ASP A   9
TYR A 106
CYH A 136
 None
 1.32A 2wt9A-3o90A:
22.0		 2wt9A-3o90A:
32.39
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2WT9_B_NIOB1216_1
(NICOTINAMIDASE)		 3o90 NICOTINAMIDASE
(Streptococcus
pneumoniae) 		6 / 9 ASP A   9
PHE A  14
LEU A  21
ASP A  53
HIS A  71
CYH A 136
 None
None
None
ZN  A 192 (-2.3A)
ZN  A 192 (-3.2A)
None
 0.60A 2wt9B-3o90A:
21.9		 2wt9B-3o90A:
32.39
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.
3O1C_A_ADNA127_1
(HISTIDINE TRIAD
NUCLEOTIDE-BINDING
PROTEIN 1)		 3o90 NICOTINAMIDASE
(Streptococcus
pneumoniae) 		5 / 10 ILE A 151
ILE A 153
SER A 107
LEU A 138
HIS A 172
 None
 1.25A 3o1cA-3o90A:
undetectable		 3o1cA-3o90A:
19.82
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.
3O1X_A_ADNA1450_1
(HISTIDINE TRIAD
NUCLEOTIDE-BINDING
PROTEIN 1)		 3o90 NICOTINAMIDASE
(Streptococcus
pneumoniae) 		5 / 10 ILE A 151
ILE A 153
SER A 107
LEU A 138
HIS A 172
 None
 1.19A 3o1xA-3o90A:
undetectable		 3o1xA-3o90A:
20.72
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3O94_A_NCAA192_0
(NICOTINAMIDASE)		 3o90 NICOTINAMIDASE
(Streptococcus
pneumoniae) 		10 / 11 ASP A   9
PHE A  14
LEU A  21
ASP A  53
GLU A  64
PHE A  68
HIS A  71
TYR A 106
LEU A 132
ILE A 135
 None
None
None
ZN  A 192 (-2.3A)
ZN  A 192 (-2.6A)
None
ZN  A 192 (-3.2A)
None
None
None
 0.65A 3o94A-3o90A:
36.9		 3o94A-3o90A:
99.53
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3O94_B_NCAB192_0
(NICOTINAMIDASE)		 3o90 NICOTINAMIDASE
(Streptococcus
pneumoniae) 		10 / 11 ASP A   9
PHE A  14
LEU A  21
ASP A  53
GLU A  64
PHE A  68
HIS A  71
TYR A 106
LEU A 132
ILE A 135
 None
None
None
ZN  A 192 (-2.3A)
ZN  A 192 (-2.6A)
None
ZN  A 192 (-3.2A)
None
None
None
 0.62A 3o94B-3o90A:
37.0		 3o94B-3o90A:
99.53
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3O94_C_NCAC192_0
(NICOTINAMIDASE)		 3o90 NICOTINAMIDASE
(Streptococcus
pneumoniae) 		10 / 11 ASP A   9
PHE A  14
LEU A  21
ASP A  53
GLU A  64
PHE A  68
HIS A  71
TYR A 106
LEU A 132
ILE A 135
 None
None
None
ZN  A 192 (-2.3A)
ZN  A 192 (-2.6A)
None
ZN  A 192 (-3.2A)
None
None
None
 0.67A 3o94C-3o90A:
36.8		 3o94C-3o90A:
99.53
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3O94_D_NCAD192_0
(NICOTINAMIDASE)		 3o90 NICOTINAMIDASE
(Streptococcus
pneumoniae) 		10 / 11 ASP A   9
PHE A  14
LEU A  21
ASP A  53
GLU A  64
PHE A  68
HIS A  71
TYR A 106
LEU A 132
ILE A 135
 None
None
None
ZN  A 192 (-2.3A)
ZN  A 192 (-2.6A)
None
ZN  A 192 (-3.2A)
None
None
None
 0.65A 3o94D-3o90A:
37.0		 3o94D-3o90A:
99.53
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.
3QGZ_A_ADNA127_1
(HISTIDINE TRIAD
NUCLEOTIDE-BINDING
PROTEIN 1)		 3o90 NICOTINAMIDASE
(Streptococcus
pneumoniae) 		5 / 10 ILE A 151
ILE A 153
SER A 107
LEU A 138
HIS A 172
 None
 1.19A 3qgzA-3o90A:
undetectable		 3qgzA-3o90A:
20.27
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_A_NIOA311_1
(ALPHA/BETA-HYDROLASE
-LIKE PROTEIN)		 3o90 NICOTINAMIDASE
(Streptococcus
pneumoniae) 		5 / 9 ASP A   9
LEU A  21
ASP A  53
HIS A  71
LYS A 103
 None
None
ZN  A 192 (-2.3A)
ZN  A 192 (-3.2A)
None
 0.56A 3r2jA-3o90A:
23.1		 3r2jA-3o90A:
28.45
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)		 3o90 NICOTINAMIDASE
(Streptococcus
pneumoniae) 		7 / 11 ASP A   9
PHE A  14
LEU A  21
ASP A  53
HIS A  71
LYS A 103
TYR A 106
 None
None
None
ZN  A 192 (-2.3A)
ZN  A 192 (-3.2A)
None
None
 0.61A 3r2jB-3o90A:
22.7		 3r2jB-3o90A:
28.45
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_C_NIOC311_1
(ALPHA/BETA-HYDROLASE
-LIKE PROTEIN)		 3o90 NICOTINAMIDASE
(Streptococcus
pneumoniae) 		7 / 12 ASP A   9
PHE A  14
LEU A  21
ASP A  53
HIS A  55
HIS A  71
TYR A 106
 None
None
None
ZN  A 192 (-2.3A)
ZN  A 192 (-3.3A)
ZN  A 192 (-3.2A)
None
 0.55A 3r2jC-3o90A:
23.1		 3r2jC-3o90A:
28.45
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_C_NIOC311_1
(ALPHA/BETA-HYDROLASE
-LIKE PROTEIN)		 3o90 NICOTINAMIDASE
(Streptococcus
pneumoniae) 		7 / 12 ASP A   9
PHE A  14
LEU A  21
ASP A  53
HIS A  71
LYS A 103
TYR A 106
 None
None
None
ZN  A 192 (-2.3A)
ZN  A 192 (-3.2A)
None
None
 0.58A 3r2jC-3o90A:
23.1		 3r2jC-3o90A:
28.45
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_D_NIOD311_1
(ALPHA/BETA-HYDROLASE
-LIKE PROTEIN)		 3o90 NICOTINAMIDASE
(Streptococcus
pneumoniae) 		7 / 11 ASP A   9
PHE A  14
LEU A  21
ASP A  53
HIS A  71
LYS A 103
TYR A 106
 None
None
None
ZN  A 192 (-2.3A)
ZN  A 192 (-3.2A)
None
None
 0.63A 3r2jD-3o90A:
22.9		 3r2jD-3o90A:
28.45
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.
4G1B_D_ECND403_1
(FLAVOHEMOGLOBIN)		 3o90 NICOTINAMIDASE
(Streptococcus
pneumoniae) 		5 / 12 ILE A  52
THR A  51
PHE A  50
VAL A 131
ILE A  30
 None
 1.13A 4g1bD-3o90A:
6.7		 4g1bD-3o90A:
19.61
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.
4PTH_A_FOLA201_1
(DIHYDROFOLATE
REDUCTASE)		 3o90 NICOTINAMIDASE
(Streptococcus
pneumoniae) 		3 / 3 ASP A  84
LEU A  85
PHE A  88
 None
 0.69A 4pthA-3o90A:
2.5		 4pthA-3o90A:
23.21
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.
5ESF_A_TPFA602_1
(LANOSTEROL 14-ALPHA
DEMETHYLASE)		 3o90 NICOTINAMIDASE
(Streptococcus
pneumoniae) 		4 / 8 TYR A 149
ILE A 151
THR A  51
LEU A 114
 None
 0.91A 5esfA-3o90A:
undetectable		 5esfA-3o90A:
17.72
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.
5ESM_A_TPFA602_1
(LANOSTEROL 14-ALPHA
DEMETHYLASE)		 3o90 NICOTINAMIDASE
(Streptococcus
pneumoniae) 		4 / 7 TYR A 149
ILE A 151
THR A  51
LEU A 114
 None
 0.89A 5esmA-3o90A:
undetectable		 5esmA-3o90A:
17.91
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.
5HES_A_032A401_2
(MITOGEN-ACTIVATED
PROTEIN KINASE
KINASE KINASE MLT)		 3o90 NICOTINAMIDASE
(Streptococcus
pneumoniae) 		4 / 6 PHE A  50
SER A 124
VAL A 123
ASP A  46
 None
 1.15A 5hesA-3o90A:
undetectable		 5hesA-3o90A:
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.
5JGL_B_SAMB301_1
(UBIE/COQ5 FAMILY
METHYLTRANSFERASE,
PUTATIVE)		 3o90 NICOTINAMIDASE
(Streptococcus
pneumoniae) 		3 / 3 ASP A 102
ASN A  72
PHE A  49
 None
 0.90A 5jglB-3o90A:
2.7		 5jglB-3o90A:
22.98
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.
5O4Y_D_CCSD14_0
(PHE-MAA-ASN-PRO-HIS-
LEU-SER-TRP-SER-TRP-
9KK-9KK-ARG-CCS-GLY-
NH2
PROGRAMMED CELL
DEATH 1 LIGAND 1)		 3o90 NICOTINAMIDASE
(Streptococcus
pneumoniae) 		5 / 12 SER A  18
GLY A  19
GLU A  12
GLY A  78
THR A  76
 None
 1.32A 5o4yD-3o90A:
undetectable
5o4yE-3o90A:
undetectable		 5o4yD-3o90A:
12.90
5o4yE-3o90A:
20.56
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.
6H1L_B_FJQB501_0
(BIFUNCTIONAL
CYTOCHROME
P450/NADPH--P450
REDUCTASE)		 3o90 NICOTINAMIDASE
(Streptococcus
pneumoniae) 		5 / 11 ALA A  54
PHE A  14
THR A  11
THR A 140
ALA A 108
 None
 1.13A 6h1lB-3o90A:
undetectable		 6h1lB-3o90A:
17.93