SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '1iwd'

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
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1STF_E_CCSE25_0
(PAPAIN
STEFIN B (CYSTATIN
B))		 1iwd ERVATAMIN B
(Tabernaemontana
divaricata) 		6 / 10 GLN A  19
GLY A  23
SER A  24
PHE A  28
SER A  29
GLY A  65
 THJ  A 601 (-3.6A)
THJ  A 601 (-3.0A)
None
None
None
THJ  A 601 (-3.6A)
 1.15A 1stfE-1iwdA:
37.1
1stfI-1iwdA:
undetectable		 1stfE-1iwdA:
48.18
1stfI-1iwdA:
17.67
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1STF_E_CCSE25_0
(PAPAIN
STEFIN B (CYSTATIN
B))		 1iwd ERVATAMIN B
(Tabernaemontana
divaricata) 		7 / 10 GLN A  19
GLY A  23
SER A  24
TRP A  26
PHE A  28
SER A  29
HIS A 158
 THJ  A 601 (-3.6A)
THJ  A 601 (-3.0A)
None
None
None
None
THJ  A 601 (-4.6A)
 0.19A 1stfE-1iwdA:
37.1
1stfI-1iwdA:
undetectable		 1stfE-1iwdA:
48.18
1stfI-1iwdA:
17.67
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.
3AI8_A_HNQA255_1
(CATHEPSIN B)		 1iwd ERVATAMIN B
(Tabernaemontana
divaricata) 		4 / 7 GLN A  19
GLY A  23
HIS A 158
TRP A 180
 THJ  A 601 (-3.6A)
THJ  A 601 (-3.0A)
THJ  A 601 (-4.6A)
None
 0.48A 3ai8A-1iwdA:
27.0		 3ai8A-1iwdA:
27.97
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.
5L1F_A_6ZPA902_1
(GLUTAMATE RECEPTOR 2)		 1iwd ERVATAMIN B
(Tabernaemontana
divaricata) 		4 / 8 PRO A 128
SER A  47
ASN A  14
SER A 130
 None
 1.14A 5l1fA-1iwdA:
undetectable
5l1fB-1iwdA:
undetectable		 5l1fA-1iwdA:
14.56
5l1fB-1iwdA:
14.56
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.
5LG3_J_Z80J401_1
(GAMMA-AMINOBUTYRIC-A
CID RECEPTOR SUBUNIT
BETA-1)		 1iwd ERVATAMIN B
(Tabernaemontana
divaricata) 		5 / 12 ILE A 190
VAL A 176
ASN A 195
GLU A 117
ILE A 205
 None
 1.19A 5lg3J-1iwdA:
0.0		 5lg3J-1iwdA:
20.06
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.
5UC1_A_486A801_2
(GLUCOCORTICOID
RECEPTOR)		 1iwd ERVATAMIN B
(Tabernaemontana
divaricata) 		3 / 3 TRP A  26
MET A  68
ASN A  69
 None
 1.14A 5uc1B-1iwdA:
0.0		 5uc1B-1iwdA:
13.62
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.
5UC1_B_486B801_1
(GLUCOCORTICOID
RECEPTOR)		 1iwd ERVATAMIN B
(Tabernaemontana
divaricata) 		3 / 3 TRP A  26
MET A  68
ASN A  69
 None
 1.13A 5uc1A-1iwdA:
0.0		 5uc1A-1iwdA:
13.62