SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3hwn'

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.
1C4D_A_DVAA6_0
(GRAMICIDIN A)		 3hwn CATHEPSIN L1
(Homo
sapiens) 		3 / 3 ALA A  33
VAL A 168
TRP A   7
 None
 0.98A 1c4dA-3hwnA:
undetectable
1c4dB-3hwnA:
undetectable		 1c4dA-3hwnA:
5.53
1c4dB-3hwnA:
5.53
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))		 3hwn CATHEPSIN L1
(Homo
sapiens) 		7 / 10 GLN A  19
GLY A  23
SER A  24
TRP A  26
PHE A  28
SER A  29
HIS A 163
 BD3  A 221 (-3.4A)
BD3  A 221 ( 3.9A)
None
None
None
None
BD3  A 221 (-4.6A)
 0.32A 1stfE-3hwnA:
34.1
1stfI-3hwnA:
undetectable		 1stfE-3hwnA:
34.22
1stfI-3hwnA:
17.58
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.
2OKC_A_SAMA500_0
(TYPE I RESTRICTION
ENZYME STYSJI M
PROTEIN)		 3hwn CATHEPSIN L1
(Homo
sapiens) 		5 / 12 TYR A 217
ILE A 211
ALA A 121
VAL A 129
PRO A 116
 None
 1.05A 2okcA-3hwnA:
undetectable		 2okcA-3hwnA:
21.86
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)		 3hwn CATHEPSIN L1
(Homo
sapiens) 		4 / 7 GLN A  19
GLY A  23
HIS A 163
TRP A 189
 BD3  A 221 (-3.4A)
BD3  A 221 ( 3.9A)
BD3  A 221 (-4.6A)
None
 0.32A 3ai8A-3hwnA:
27.8		 3ai8A-3hwnA:
27.87
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.
4QC6_B_KANB201_2
(BIFUNCTIONAL AAC/APH)		 3hwn CATHEPSIN L1
(Homo
sapiens) 		3 / 3 LEU A  69
ASP A  71
TYR A  72
 BD3  A 221 (-3.7A)
BD3  A 221 (-2.7A)
BD3  A 221 (-4.8A)
 0.55A 4qc6B-3hwnA:
undetectable		 4qc6B-3hwnA:
20.31
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.
5D4U_C_SAMC301_1
(UNCHARACTERIZED
PROTEIN MJ0489)		 3hwn CATHEPSIN L1
(Homo
sapiens) 		4 / 4 LYS A  17
ASP A  55
GLU A  86
THR A  31
 None
 1.44A 5d4uC-3hwnA:
undetectable		 5d4uC-3hwnA:
24.75
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.
5D4U_D_SAMD301_1
(UNCHARACTERIZED
PROTEIN MJ0489)		 3hwn CATHEPSIN L1
(Homo
sapiens) 		4 / 4 LYS A  17
ASP A  55
GLU A  86
THR A  31
 None
 1.44A 5d4uD-3hwnA:
undetectable		 5d4uD-3hwnA:
24.75
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.
5TUD_A_ERMA2001_2
(5-HYDROXYTRYPTAMINE
RECEPTOR 2B,SOLUBLE
CYTOCHROME B562
CHIMERA)		 3hwn CATHEPSIN L1
(Homo
sapiens) 		4 / 7 LEU A 144
ASN A 187
VAL A 199
GLU A 192
 None
 1.07A 5tudA-3hwnA:
undetectable		 5tudA-3hwnA:
19.21