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Structure of PDB 1cyd Chain C Binding Site BS02

Receptor Information >1cyd Chain C (length=242) Species: 10090 (Mus musculus) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure] LNFSGLRALVTGAGKGIGRDTVKALHASGAKVVAVTRTNSDLVSLAKECP GIEPVCVDLGDWDATEKALGGIGPVDLLVNNAALVIMQPFLEVTKEAFDR SFSVNLRSVFQVSQMVARDMINRGVPGSIVNVSSMVAHVTFPNLITYSST KGAMTMLTKAMAMELGPHKIRVNSVNPTVVLTDMGKKVSADPEFARKLKE RHPLRKFAEVEDVVNSILFLLSDRSASTSGGGILVDAGYLAS

Ligand information Ligand ID IPA InChI InChI=1S/C3H8O/c1-3(2)4/h3-4H,1-2H3 InChIKey KFZMGEQAYNKOFK-UHFFFAOYSA-N SMILES Software SMILES ACDLabs 11.02 OC(C)C CACTVS 3.352 OpenEye OEToolkits 1.7.0 CC(C)O Formula C3 H8 O Name ISOPROPYL ALCOHOL; 2-PROPANOL ChEMBL CHEMBL582 DrugBank DB02325 ZINC ZINC000000901159 PDB chain 1cyd Chain C Residue 246 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]

Receptor-Ligand Complex Structure Global view Local view Structure summary [Spin on] [Spin off] [Reset] [High quality] [Low quality] [White background] [Black background] [Spin on] [Spin off] [Reset] [High quality] [Low quality] [White background] [Black background] PDB 1cyd Crystal structure of the ternary complex of mouse lung carbonyl reductase at 1.8 A resolution: the structural origin of coenzyme specificity in the short-chain dehydrogenase/reductase family. Resolution 1.8 Å Binding residue (original residue number in PDB) S136 Y149 Binding residue (residue number reindexed from 1) S134 Y147 Annotation score 1

Enzymatic activity Catalytic site (original residue number in PDB) G18 S136 L146 Y149 K153 Catalytic site (residue number reindexed from 1) G16 S134 L144 Y147 K151 Enzyme Commision number 1.1.1.184: carbonyl reductase (NADPH).

Gene Ontology Molecular Function GO:0004090 carbonyl reductase (NADPH) activity GO:0005515 protein binding GO:0016491 oxidoreductase activity GO:0042802 identical protein binding

	Biological Process
GO:0006116	NADH oxidation
GO:0044281	small molecule metabolic process

	Cellular Component
GO:0005739	mitochondrion
GO:0005759	mitochondrial matrix

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