Structure of PDB 1c6o Chain B Binding Site BS01
Receptor Information
>1c6o Chain B (length=89) Species:
3088
(Tetradesmus obliquus) [
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SADLALGKQTFEANCAACHAGGNNSVIPDHTLRKAAMEQFLQGGFNLEAI
TYQVENGKGAMPAWSGTLDDDEIAAVAAYVYDQASGDKW
Ligand information
Ligand ID
HEM
InChI
InChI=1S/C34H34N4O4.Fe/c1-7-21-17(3)25-13-26-19(5)23(9-11-33(39)40)31(37-26)16-32-24(10-12-34(41)42)20(6)28(38-32)15-30-22(8-2)18(4)27(36-30)14-29(21)35-25;/h7-8,13-16H,1-2,9-12H2,3-6H3,(H4,35,36,37,38,39,40,41,42);/q;+2/p-2/b25-13-,26-13-,27-14-,28-15-,29-14-,30-15-,31-16-,32-16-;
InChIKey
KABFMIBPWCXCRK-RGGAHWMASA-L
SMILES
Software
SMILES
OpenEye OEToolkits 1.7.6
Cc1c2n3c(c1CCC(=O)O)C=C4C(=C(C5=[N]4[Fe]36[N]7=C(C=C8N6C(=C5)C(=C8C)C=C)C(=C(C7=C2)C)C=C)C)CCC(=O)O
CACTVS 3.385
CC1=C(CCC(O)=O)C2=Cc3n4[Fe]5|6|N2=C1C=c7n5c(=CC8=N|6C(=Cc4c(C)c3CCC(O)=O)C(=C8C=C)C)c(C)c7C=C
ACDLabs 12.01
C=1c3c(c(c4C=C5C(=C(C=6C=C7C(=C(C8=CC=2C(=C(C=1N=2[Fe](n34)(N5=6)N78)CCC(=O)O)C)\C=C)C)\C=C)C)C)CCC(=O)O
Formula
C34 H32 Fe N4 O4
Name
PROTOPORPHYRIN IX CONTAINING FE;
HEME
ChEMBL
DrugBank
DB18267
ZINC
PDB chain
1c6o Chain B Residue 90 [
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Receptor-Ligand Complex Structure
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PDB
1c6o
Amino acid sequence, crystallization and structure determination of reduced and oxidized cytochrome c6 from the green alga Scenedesmus obliquus.
Resolution
2.0 Å
Binding residue
(original residue number in PDB)
C15 C18 H19 N24 V26 H30 T31 L32 A36 M37 Q53 K58 M61 W64
Binding residue
(residue number reindexed from 1)
C15 C18 H19 N24 V26 H30 T31 L32 A36 M37 Q53 K58 M61 W64
Annotation score
4
Enzymatic activity
Enzyme Commision number
?
Gene Ontology
Molecular Function
GO:0005506
iron ion binding
GO:0009055
electron transfer activity
GO:0020037
heme binding
GO:0046872
metal ion binding
Biological Process
GO:0015979
photosynthesis
Cellular Component
GO:0009507
chloroplast
GO:0009543
chloroplast thylakoid lumen
GO:0009579
thylakoid
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Biological Process
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Cellular Component
External links
PDB
RCSB:1c6o
,
PDBe:1c6o
,
PDBj:1c6o
PDBsum
1c6o
PubMed
10438600
UniProt
P57736
|CYC6_TETOB Cytochrome c6 (Gene Name=petJ)
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