Structure of PDB 3g4u Chain B Binding Site BS04

Receptor Information
>3g4u Chain B (length=145) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
SVYDAAAQLTADVKKDLRDSWKVIGSDKKGNGVALMTTLFADNQETIGYF
KRLGDVSQGMANDKLRGHSITLMYALQNFIDQLDNPDDLVCVVEKFAVNH
ITRKISAAEFGKINGPIKKVLASKNFGDKYANAWAKLVAVVQAAL
Ligand information
Ligand ID0CL
InChIInChI=1S/C3H6Cl2/c4-2-1-3-5/h1-3H2
InChIKeyYHRUOJUYPBUZOS-UHFFFAOYSA-N
SMILES
SoftwareSMILES
OpenEye OEToolkits 1.5.0C(CCl)CCl
ACDLabs 10.04
CACTVS 3.341		ClCCCCl
FormulaC3 H6 Cl2
Name1,3-dichloropropane
ChEMBLCHEMBL157427
DrugBank
ZINCZINC000001693328
PDB chain3g4u Chain B Residue 150 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB3g4u Ligand migration and cavities within Scapharca Dimeric HbI: studies by time-resolved crystallo-graphy, Xe binding, and computational analysis.
Resolution2.1 Å
Binding residue
(original residue number in PDB)		S21 W22 I25 L122 W135
Binding residue
(residue number reindexed from 1)		S20 W21 I24 L121 W134
Annotation score1
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0005344 oxygen carrier activity
GO:0019825 oxygen binding
GO:0020037 heme binding
GO:0042802 identical protein binding
GO:0046872 metal ion binding
Biological Process
GO:0001666 response to hypoxia
GO:0015671 oxygen transport
Cellular Component
GO:0005737 cytoplasm

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Molecular Function
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Biological Process
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Cellular Component
External links
PDB RCSB:3g4u, PDBe:3g4u, PDBj:3g4u
PDBsum3g4u
PubMed19913484
UniProtP02213|GLB1_ANAIN Globin-1

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