Structure of PDB 5mfu Chain A Binding Site BS01

Receptor Information
>5mfu Chain A (length=254) Species: 287 (Pseudomonas aeruginosa) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
ASPSSELRRALEANEFIPYYQPLSPGQGGRWIGVEVLMRWRHPREGLIRP
DLFIPFAERSGLIVPMTRALMRQVAEDLGGHAGKLEPGFHIGFNISATHC
HELALVDDCRELLAAFPPGHITLVLELTERELIESSEVTDRLFDELHALG
VKIAIDDFGTGHSSLAYLRKFQVDCLKIDQSFVARIGIDTLSGHILDSIV
ELSAKLDLDIVAEGVETPEQRDYLAARGVDYLQGYLIGRPMPLESLLSSL
TVQE
Ligand information
Ligand IDMN
InChIInChI=1S/Mn/q+2
InChIKeyWAEMQWOKJMHJLA-UHFFFAOYSA-N
SMILES
SoftwareSMILES
ACDLabs 10.04
OpenEye OEToolkits 1.5.0		[Mn+2]
CACTVS 3.341[Mn++]
FormulaMn
NameMANGANESE (II) ION
ChEMBL
DrugBankDB06757
ZINC
PDB chain5mfu Chain A Residue 501 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
Global viewLocal viewStructure summary

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PDB5mfu Dimerisation induced formation of the active site and the identification of three metal sites in EAL-phosphodiesterases.
Resolution2.15 Å
Binding residue
(original residue number in PDB)		E39 N98 E130 D160
Binding residue
(residue number reindexed from 1)		E35 N94 E126 D156
Annotation score1
Enzymatic activity
Enzyme Commision number 3.1.4.52: cyclic-guanylate-specific phosphodiesterase.
External links