SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '2aa1'

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.
3EM0_B_CHDB153_0
(ILEAL BILE
ACID-BINDING PROTEIN)		 2aa1 HEMOGLOBIN BETA-C
CHAIN
(Trematomus
newnesi) 		4 / 7 ILE B  81
PHE B  15
PHE B 130
LYS B 132
 None
 1.08A 3em0B-2aa1B:
undetectable		 3em0B-2aa1B:
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.
3IB1_A_IMNA701_1
(LACTOTRANSFERRIN)		 2aa1 HEMOGLOBIN BETA-C
CHAIN
(Trematomus
newnesi) 		4 / 4 PRO B  36
THR B  38
GLY B  64
THR B  65
 None
HEM  B 400 (-4.1A)
None
None
 1.11A 3ib1A-2aa1B:
undetectable		 3ib1A-2aa1B:
16.08
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.
3QPS_A_CHDA211_0
(CMER)		 2aa1 HEMOGLOBIN BETA-C
CHAIN
(Trematomus
newnesi) 		5 / 10 LEU B 106
ALA B  26
GLY B  64
ILE B  67
PHE B 130
 HEM  B 400 (-4.0A)
None
None
HEM  B 400 (-4.1A)
None
 1.43A 3qpsA-2aa1B:
undetectable		 3qpsA-2aa1B:
20.49
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.
4DO3_A_0LAA602_1
(FATTY-ACID AMIDE
HYDROLASE 1)		 2aa1 HEMOGLOBIN BETA-C
CHAIN
(Trematomus
newnesi) 		4 / 5 LEU B  18
LEU B  68
MET B 134
THR B  27
 None
 1.14A 4do3A-2aa1B:
undetectable		 4do3A-2aa1B:
12.24
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.
4EJJ_A_NCTA501_1
(CYTOCHROME P450 2A6)		 2aa1 HEMOGLOBIN BETA-C
CHAIN
(Trematomus
newnesi) 		4 / 7 PHE B  15
GLY B  70
ILE B  81
PHE B 133
 None
HEM  B 400 ( 4.3A)
None
None
 0.87A 4ejjA-2aa1B:
undetectable		 4ejjA-2aa1B:
15.68
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.
5H1E_A_VDXA501_1
(VITAMIN D3 RECEPTOR)		 2aa1 HEMOGLOBIN BETA-C
CHAIN
(Trematomus
newnesi) 		5 / 12 PHE B  15
LEU B  71
ILE B  67
VAL B 138
HIS B  92
 None
HEM  B 400 ( 4.8A)
HEM  B 400 (-4.1A)
None
HEM  B 400 (-3.4A)
 1.21A 5h1eA-2aa1B:
undetectable		 5h1eA-2aa1B:
20.73
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.
5SYF_B_TA1B502_1
(TUBULIN BETA CHAIN)		 2aa1 HEMOGLOBIN BETA-C
CHAIN
(Trematomus
newnesi) 		5 / 12 VAL B  75
ASP B  72
ASP B  13
ARG B 117
LEU B 110
 None
 1.29A 5syfB-2aa1B:
undetectable		 5syfB-2aa1B:
15.85
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.
6DHB_A_BEZA202_0
(HEPATITIS A VIRUS
CELLULAR RECEPTOR 2)		 2aa1 HEMOGLOBIN BETA-C
CHAIN
(Trematomus
newnesi) 		4 / 6 ILE B  81
MET B  78
ASN B  77
ASP B  79
 None
 1.43A 6dhbA-2aa1B:
undetectable		 6dhbA-2aa1B:
22.97