Structure of PDB 9baz Chain A Binding Site BS02

Receptor Information

>9baz Chain A (length=965) Species: 5141 (Neurospora crassa)

QRSKHITVDLPVSTLINPRSTFQRIDENDNLVPPPQSTPERVAVEDLLKA
AKAAGKNKEDYIEFELHDFNFYVNYAYHPQEMRPIQLVATKVLHDKYYFD
GVLKYGNTKHYVTGMQVLELPVGNYGASLHSVKGQIWVRSKHNAKKEIYY
LLKKPAFEYQRYYQPFLWIADLGKHVVDYCTRMVERKREVTLGCFKSDFI
QWASKAHGKSKAFQNWRAQHPSDDFRTSVAANIGYIWKEINGVAGAKRAA
GDQLFRELMIVKPGQYFRQEVPPGPVVTEGDRTVAATIVTPYIKECFGHM
ILGKVLRLAGELVNKIKVGDVISTPRHRWFGLVQRVHTAKSFDVIWFYRP
EDTPCCAMKYKWRNELFLSNHCTCQEGHHARVKGNEVLAVHPVDWFGTPE
SNKGEFFVRQLYESEQRRWITLQKDHLTCYHNQPPAPYKPGDTVLATLSP
SDKFSDPYEVVEYFTQGEKETAFVRLRKLLRRRKVDRQDAPANELVYTED
LVDVRAERIVGKCIMRCFRPDERVPSPYDRGGTGNMFFITHRQDHGRCVP
LDTLPPTLRQGFNPLGNLGKPKLRGMDLYCGGGNFGRGLEEGGVVEMRWA
NDIWDKAIHTYMANTPDPNKTNPFLGSVDDLLRLALEGKFSDNVPRPGEV
DFIAAGSPCPGFSLLKVLNQVKNQSLVASFASFVDFYRPKYGVLENVSGI
VQTFVNRKQDVLSQLFCALVGMGYQAQLILGDAWAHGAPQSRERVFLYFA
APGLPLPDPPLPSHSHYRVKNRNIGFLCNGESYVQRSFIPTAFKFVSAGE
GTADLPKIGDGKPDACVRFPDHRLASGITPYIRAQYACIPTHPYGMNFIK
AWNNGNGVMSKSDRDLFPSEGASVGWKRLNPKTLFPTVTTTSNPSDARMG
PGLHWDEDRPYTVQEMRRAQGYLDEEVLVGRTTDQWKLVGNSVSRHMALA
IGLKFREAWLGTLYD

Ligand information

• Ligand ID: ZN
• InChI: InChI=1S/Zn/q+2
• InChIKey: PTFCDOFLOPIGGS-UHFFFAOYSA-N
• SMILES:
  CACTVS 3.341: [Zn++]
  ACDLabs 10.04
  OpenEye OEToolkits 1.5.0: [Zn+2]
• Formula: Zn
• Name: ZINC ION
• ChEMBL: CHEMBL1236970
• DrugBank: DB14532
• PDB chain: 9baz Chain A Residue 1302

Receptor-Ligand Complex Structure

Structure summary

• PDB: 9baz CryoEM structure of DIM2-HP1 complex
• Resolution: 2.76 Å
• Binding residue (original residue number in PDB): C635 C637 C692 H694
• Binding residue (residue number reindexed from 1): C372 C374 C429 H431
• Annotation score: 4

External links

• PDB: RCSB:9baz, PDBe:9baz, PDBj:9baz
• PDBsum: 9baz
• UniProt: Q96W73