SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3ccg'

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.
1EI6_D_PPFD412_1
(PHOSPHONOACETATE
HYDROLASE)		 3ccg HD SUPERFAMILY
HYDROLASE
(Clostridium
acetobutylicum) 		4 / 8 ASP A  52
HIS A  51
HIS A 111
HIS A  22
 FE  A 190 (-2.6A)
FE  A 191 (-3.7A)
FE  A 190 (-3.4A)
FE  A 191 ( 3.5A)
 0.68A 1ei6D-3ccgA:
undetectable		 1ei6D-3ccgA:
17.85
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.
1FWE_C_HAEC989_1
(UREASE)		 3ccg HD SUPERFAMILY
HYDROLASE
(Clostridium
acetobutylicum) 		5 / 6 HIS A  51
HIS A  22
HIS A  85
HIS A 111
ASP A 129
 FE  A 191 (-3.7A)
FE  A 191 ( 3.5A)
FE  A 190 ( 3.4A)
FE  A 190 (-3.4A)
FE  A 191 ( 2.4A)
 1.19A 1fweC-3ccgA:
undetectable		 1fweC-3ccgA:
17.03
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.
2VUF_B_FUAB2002_1
(SERUM ALBUMIN)		 3ccg HD SUPERFAMILY
HYDROLASE
(Clostridium
acetobutylicum) 		4 / 9 ILE A  97
ALA A  47
VAL A  50
CYH A  53
 None
 0.84A 2vufB-3ccgA:
undetectable		 2vufB-3ccgA:
14.73
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.
2XAD_E_GCSE710_1
(N-ACYL GLM
PEUDO-TEICOPLANIN
DEACETYLASE
TEICOPLANIN)		 3ccg HD SUPERFAMILY
HYDROLASE
(Clostridium
acetobutylicum) 		4 / 8 HIS A 111
ASP A 129
HIS A  85
ASP A  52
 FE  A 190 (-3.4A)
FE  A 191 ( 2.4A)
FE  A 190 ( 3.4A)
FE  A 190 (-2.6A)
 1.01A 2xadA-3ccgA:
undetectable		 2xadA-3ccgA:
19.71
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.
2XAD_F_GCSF710_1
(N-ACYL GLM
PEUDO-TEICOPLANIN
DEACETYLASE
TEICOPLANIN)		 3ccg HD SUPERFAMILY
HYDROLASE
(Clostridium
acetobutylicum) 		4 / 8 HIS A 111
ASP A 129
HIS A  85
ASP A  52
 FE  A 190 (-3.4A)
FE  A 191 ( 2.4A)
FE  A 190 ( 3.4A)
FE  A 190 (-2.6A)
 1.03A 2xadB-3ccgA:
undetectable		 2xadB-3ccgA:
19.71
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.
2XAD_G_GCSG710_1
(N-ACYL GLM
PEUDO-TEICOPLANIN
DEACETYLASE
TEICOPLANIN)		 3ccg HD SUPERFAMILY
HYDROLASE
(Clostridium
acetobutylicum) 		4 / 8 HIS A 111
ASP A 129
HIS A  85
ASP A  52
 FE  A 190 (-3.4A)
FE  A 191 ( 2.4A)
FE  A 190 ( 3.4A)
FE  A 190 (-2.6A)
 1.01A 2xadC-3ccgA:
undetectable		 2xadC-3ccgA:
19.71
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.
2XAD_H_GCSH710_1
(N-ACYL GLM
PEUDO-TEICOPLANIN
DEACETYLASE
TEICOPLANIN)		 3ccg HD SUPERFAMILY
HYDROLASE
(Clostridium
acetobutylicum) 		4 / 8 HIS A 111
ASP A 129
HIS A  85
ASP A  52
 FE  A 190 (-3.4A)
FE  A 191 ( 2.4A)
FE  A 190 ( 3.4A)
FE  A 190 (-2.6A)
 1.03A 2xadD-3ccgA:
undetectable		 2xadD-3ccgA:
19.71
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.
4MK4_B_CHDB504_0
(FERROCHELATASE,
MITOCHONDRIAL)		 3ccg HD SUPERFAMILY
HYDROLASE
(Clostridium
acetobutylicum) 		3 / 3 LEU A 173
ILE A 178
ARG A 181
 None
 0.63A 4mk4B-3ccgA:
undetectable		 4mk4B-3ccgA:
19.24
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.
4UBP_C_HAEC800_1
(PROTEIN (UREASE
(CHAIN C)))		 3ccg HD SUPERFAMILY
HYDROLASE
(Clostridium
acetobutylicum) 		5 / 6 HIS A  51
HIS A  22
HIS A  85
HIS A 111
ASP A 129
 FE  A 191 (-3.7A)
FE  A 191 ( 3.5A)
FE  A 190 ( 3.4A)
FE  A 190 (-3.4A)
FE  A 191 ( 2.4A)
 1.08A 4ubpC-3ccgA:
undetectable		 4ubpC-3ccgA:
18.64
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.
5NCD_A_ACTA301_0
(PEPTIDOGLYCAN
N-ACETYLGLUCOSAMINE
DEACETYLASE)		 3ccg HD SUPERFAMILY
HYDROLASE
(Clostridium
acetobutylicum) 		4 / 6 ASP A  52
HIS A 111
HIS A  85
HIS A  22
 FE  A 190 (-2.6A)
FE  A 190 (-3.4A)
FE  A 190 ( 3.4A)
FE  A 191 ( 3.5A)
 0.90A 5ncdA-3ccgA:
undetectable
5ncdD-3ccgA:
undetectable		 5ncdA-3ccgA:
20.46
5ncdD-3ccgA:
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.
5NCD_C_ACTC301_0
(PEPTIDOGLYCAN
N-ACETYLGLUCOSAMINE
DEACETYLASE)		 3ccg HD SUPERFAMILY
HYDROLASE
(Clostridium
acetobutylicum) 		4 / 6 ASP A  52
HIS A 111
HIS A  85
HIS A  22
 FE  A 190 (-2.6A)
FE  A 190 (-3.4A)
FE  A 190 ( 3.4A)
FE  A 191 ( 3.5A)
 0.94A 5ncdB-3ccgA:
undetectable
5ncdC-3ccgA:
undetectable		 5ncdB-3ccgA:
20.46
5ncdC-3ccgA:
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.
5NEK_B_AZMB302_1
(PEPTIDOGLYCAN
N-ACETYLGLUCOSAMINE
DEACETYLASE)		 3ccg HD SUPERFAMILY
HYDROLASE
(Clostridium
acetobutylicum) 		4 / 8 ASP A  52
HIS A 111
HIS A  85
HIS A  22
 FE  A 190 (-2.6A)
FE  A 190 (-3.4A)
FE  A 190 ( 3.4A)
FE  A 191 ( 3.5A)
 0.94A 5nekB-3ccgA:
undetectable		 5nekB-3ccgA:
17.37
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.
5NEL_A_ACTA302_0
(PEPTIDOGLYCAN
N-ACETYLGLUCOSAMINE
DEACETYLASE)		 3ccg HD SUPERFAMILY
HYDROLASE
(Clostridium
acetobutylicum) 		4 / 6 ASP A  52
HIS A 111
HIS A  85
HIS A  22
 FE  A 190 (-2.6A)
FE  A 190 (-3.4A)
FE  A 190 ( 3.4A)
FE  A 191 ( 3.5A)
 0.88A 5nelA-3ccgA:
undetectable
5nelD-3ccgA:
undetectable		 5nelA-3ccgA:
20.46
5nelD-3ccgA:
20.46