Structure of PDB 3ikn Chain A Binding Site BS04
Receptor Information
>3ikn Chain A (length=152) Species:
9606
(Homo sapiens) [
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VASLRQQVEALQGQVQHLQAAFSQYKKVELFPNGQSVGEKIFKTAGFVKP
FTEAQLLCTQAGGQLASPRSAAENAALQQLVVAKNEAAFLSMTDSKTEGK
FTYPTGESLVYSNWAPGEPNDDGGSEDCVEIFTNGKWNDRACGEKRLVVC
EF
Ligand information
Ligand ID
GAL
InChI
InChI=1S/C6H12O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-11H,1H2/t2-,3+,4+,5-,6-/m1/s1
InChIKey
WQZGKKKJIJFFOK-FPRJBGLDSA-N
SMILES
Software
SMILES
CACTVS 3.370
OC[C@H]1O[C@@H](O)[C@H](O)[C@@H](O)[C@H]1O
OpenEye OEToolkits 1.7.2
C(C1C(C(C(C(O1)O)O)O)O)O
CACTVS 3.370
OC[CH]1O[CH](O)[CH](O)[CH](O)[CH]1O
ACDLabs 12.01
OC1C(O)C(OC(O)C1O)CO
OpenEye OEToolkits 1.7.2
C([C@@H]1[C@@H]([C@@H]([C@H]([C@@H](O1)O)O)O)O)O
Formula
C6 H12 O6
Name
beta-D-galactopyranose;
beta-D-galactose;
D-galactose;
galactose
ChEMBL
CHEMBL300520
DrugBank
ZINC
ZINC000002597049
PDB chain
3ikn Chain A Residue 405 [
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Receptor-Ligand Complex Structure
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PDB
3ikn
Structural characterisation of ligand-binding determinants in human lung surfactant protein D: influence of Asp325
Resolution
1.6 Å
Binding residue
(original residue number in PDB)
E321 N323 E329 N341 R343
Binding residue
(residue number reindexed from 1)
E118 N120 E126 N138 R140
Annotation score
4
Enzymatic activity
Enzyme Commision number
?
External links
PDB
RCSB:3ikn
,
PDBe:3ikn
,
PDBj:3ikn
PDBsum
3ikn
PubMed
19799916
UniProt
P35247
|SFTPD_HUMAN Pulmonary surfactant-associated protein D (Gene Name=SFTPD)
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