Structure of PDB 7dz6 Chain C Binding Site BS01

Receptor Information
>7dz6 Chain C (length=283) Species: 1128334 (Sinorhizobium fredii CCBAU 83666) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
TMQGFGVHTSMWTMNWDRPGAERAVAAALKYEVDFIEIPMLNPPAVDTEH
TRALLEKNELRALCSLGLPERAWASVRPDAAIEHLKVAIDKTADLGGEAL
SGVIYGGIGERTGVPPTEAEYDNIARVLSAAAKHAKSRGIELGVEAVNRY
ENHLINTGWQAVQMIERVGADNIFVHLDTYHMNIEEKGVGNGILDAREHL
KYIHLSESDRGTPGYGTCGWDEIFSTLAAIGFKGGLAMESFINMPPEVAY
GLAVWRPVAKDEEEVMGNGLPFLRNKAKQYGLI
Ligand information
Ligand IDPSJ
InChIInChI=1S/C6H12O6/c7-1-3(9)5(11)6(12)4(10)2-8/h3,5-9,11-12H,1-2H2/t3-,5-,6+/m1/s1
InChIKeyBJHIKXHVCXFQLS-PUFIMZNGSA-N
SMILES
SoftwareSMILES
OpenEye OEToolkits 1.7.0C([C@H]([C@H]([C@H](C(=O)CO)O)O)O)O
CACTVS 3.352OC[C@@H](O)[C@@H](O)[C@@H](O)C(=O)CO
ACDLabs 11.02O=C(C(O)C(O)C(O)CO)CO
OpenEye OEToolkits 1.7.0C(C(C(C(C(=O)CO)O)O)O)O
CACTVS 3.352OC[CH](O)[CH](O)[CH](O)C(=O)CO
FormulaC6 H12 O6
NameD-psicose
ChEMBLCHEMBL1235460
DrugBankDB15087
ZINCZINC000005132035
PDB chain7dz6 Chain C Residue 301 [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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PDB7dz6 Substantial Improvement of an Epimerase for the Synthesis of D-Allulose by Biosensor-Based High-Throughput Microdroplet Screening
Resolution2.1 Å
Binding residue
(original residue number in PDB)		H9 E146 E152 H182 H205 R211 E240 L253
Binding residue
(residue number reindexed from 1)		H8 E145 E151 H181 H204 R210 E239 L252
Annotation score4
External links