Receptor
PDB id Resolution Class Description Source Keywords
2B6N 1.8 Å EC: 3.4.21.- THE 1.8 A CRYSTAL STRUCTURE OF A PROTEINASE K LIKE ENZYME FR PSYCHROTROPH SERRATIA SPECIES SERRATIA SP. S BINDING SUBSTRATE SPECIFICITY PROTEINASE K SUBTILASE PSYCHROTROPHIC PSYCHROPHILIC HYDROLASE
Ref.: THE 1.8 A CRYSTAL STRUCTURE OF A PROTEINASE K-LIKE FROM A PSYCHROTROPH SERRATIA SPECIES FEBS J. V. 273 61 2006
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
ALA PRO THR B:1;
 Valid;
 none;
 submit data
287.316 n/a O=C([...
CA A:300;
 Part of Protein;
 none;
 submit data
40.078 Ca [Ca+2...
SO4 A:301;
A:302;
 Invalid;
Invalid;
 none;
none;
 submit data
96.063 O4 S [O-]S...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
2B6N 1.8 Å EC: 3.4.21.- THE 1.8 A CRYSTAL STRUCTURE OF A PROTEINASE K LIKE ENZYME FR PSYCHROTROPH SERRATIA SPECIES SERRATIA SP. S BINDING SUBSTRATE SPECIFICITY PROTEINASE K SUBTILASE PSYCHROTROPHIC PSYCHROPHILIC HYDROLASE
Ref.: THE 1.8 A CRYSTAL STRUCTURE OF A PROTEINASE K-LIKE FROM A PSYCHROTROPH SERRATIA SPECIES FEBS J. V. 273 61 2006
Members (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 16 families.
1 2B6N - ALA PRO THR n/a n/a
70% Homology Family (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 14 families.
1 2B6N - ALA PRO THR n/a n/a
50% Homology Family (5)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1 families.
1 2B6N - ALA PRO THR n/a n/a
2 1OYO - 3ID C8 H7 N O2 c1c[nH]c2c....
3 1TK2 - VAL ORN LEU DPN PRO VAL ORN LEU DPN PRO n/a n/a
4 1SUA - ALA LEU ALA LEU n/a n/a
5 5OX2 - VAL GLU GLU ASP HIS VAL ALA HIS ALA n/a n/a
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: ALA PRO THR; Similar ligands found: 27
No: Ligand ECFP6 Tc MDL keys Tc
1 ALA PRO THR 1 1
2 ILE PRO ILE 0.553846 0.849057
3 ALA PRO 0.54717 0.84
4 ALA VAL PRO ILE 0.521127 0.851852
5 ALA VAL PRO ALA 0.514706 0.901961
6 SER VAL PRO ILE 0.493333 0.813559
7 ACE ALA PRO ALA 0.476923 0.9
8 ALA PRO THR MET PRO PRO PRO LEU PRO PRO 0.452632 0.793651
9 ASP SER THR THR PRO ALA PRO THR 0.45 0.890909
10 ALA THR PRO PHE GLN GLU 0.445783 0.872727
11 GLU PTR LEU GLY LEU ASP VAL PRO VAL 0.445783 0.821429
12 LEU PRO GLU THR GLY 0.436782 0.844828
13 ALA VAL PRO ILE ALA GLN LYS SER GLU 0.434211 0.814815
14 ALA VAL PRO ILE ALA GLN LYS 0.434211 0.814815
15 SER THR CYS PRO ALA ALA 0.433735 0.827586
16 LYS PRO LYS 0.426667 0.796296
17 ALA PRO ASP THR ARG PRO 0.424242 0.769231
18 ASN LEU VAL PRO THR VAL ALA THR VAL 0.42 0.830508
19 TYR MET ASP PHE ASP ASP ASP ILE PRO PHE 0.419753 0.803571
20 SER GLU CYS THR THR PRO CYS 0.416667 0.830508
21 ASN LEU VAL PRO VAL VAL ALA THR VAL 0.415842 0.830508
22 LEU PRO 0.412698 0.777778
23 ALA PRO PRO ALA 0.409091 0.773585
24 SER TYR SER PRO THR SEP PRO SER 0.406593 0.712121
25 THR PRO PRO SER PRO PHE 0.402174 0.8
26 CYS THR PRO SER ARG 0.402062 0.75
27 PRO THR PRO SER ALA PRO VAL PRO LEU 0.4 0.819672
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 2B6N; Ligand: ALA PRO THR; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 1) in the query (biounit: 2b6n.bio1) has 9 residues
No: Leader PDB Ligand Sequence Similarity
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