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●I-TASSER ●I-TASSER-MTD ●C-I-TASSER ●CR-I-TASSER ●QUARK ●C-QUARK ●LOMETS ●MUSTER ●CEthreader ●SEGMER ●DeepFold ●DeepFoldRNA ●FoldDesign ●COFACTOR ●COACH ●MetaGO ●TripletGO ●IonCom ●FG-MD ●ModRefiner ●REMO ●DEMO ●DEMO-EM ●SPRING ●COTH ●Threpp ●PEPPI ●BSpred ●ANGLOR ●EDock ●BSP-SLIM ●SAXSTER ●FUpred ●ThreaDom ●ThreaDomEx ●EvoDesign ●BindProf ●BindProfX ●SSIPe ●GPCR-I-TASSER ●MAGELLAN ●ResQ ●STRUM ●DAMpred

●TM-score ●TM-align ●US-align ●MM-align ●RNA-align ●NW-align ●LS-align ●EDTSurf ●MVP ●MVP-Fit ●SPICKER ●HAAD ●PSSpred ●3DRobot ●MR-REX ●I-TASSER-MR ●SVMSEQ ●NeBcon ●ResPRE ●TripletRes ●DeepPotential ●WDL-RF ●ATPbind ●DockRMSD ●DeepMSA ●FASPR ●EM-Refiner ●GPU-I-TASSER

●BioLiP ●E. coli ●GLASS ●GPCR-HGmod ●GPCR-RD ●GPCR-EXP ●Tara-3D ●TM-fold ●DECOYS ●POTENTIAL ●RW/RWplus ●EvoEF ●HPSF ●THE-DB ●ADDRESS ●Alpaca-Antibody ●CASP7 ●CASP8 ●CASP9 ●CASP10 ●CASP11 ●CASP12 ●CASP13 ●CASP14

Structure of PDB 1itw Chain C Binding Site BS01

Receptor Information >1itw Chain C (length=739) Species: 354 (Azotobacter vinelandii) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure] STPKIIYTLTDEAPALATYSLLPIIKAFTGSSGIAVETRDISLAGRLIAT FPEYLTDTQKISDDLAELGKLATTPDANIIKLPNISASVPQLKAAIKELQ QQGYKLPDYPEEPKTDTEKDVKARYDKIKGSAVNPVLREGNSDRRAPLSV KNYARKHPHKMGAWSADSKSHVAHMDNGDFYGSEKAALIGAPGSVKIELI AKDGSSTVLKAKTSVQAGEIIDSSVMSKNALRNFIAAEIEDAKKQGVLLS VHLKATMMKVSDPIMFGQIVSEFYKDALTKHAEVLKQIGFDVNNGIGDLY ARIKTLPEAKQKEIEADIQAVYAQRPQLAMVNSDKGITNLHVPSDVIVDA SMPAMIRDSGKMWGPDGKLHDTKAVIPDRCYAGVYQVVIEDCKQHGAFDP TTMGSVPNVGLMAQKAEEYGSHDKTFQIPADGVVRVTDESGKLLLEQSVE AGDIWRMCQAKDAPIQDWVKLAVNRARATNTPAVFWLDPARAHDAQVIAK VERYLKDYDTSGLDIRILSPVEATRFSLARIREGKDTISVTGNVLRDYLT DLFPIMELGTSAKMLSIVPLMSGGGLFETGAGGSAPKHVQQFLEEGYLRW DSLGEFLALAASLEHLGNAYKNPKALVLASTLDQATGKILDNNKSPARKV GEIDNRGSHFYLALYWAQALAAQTEDKELQAQFTGIAKALTDNETKIVGE LAAAQGKPVDIAGYYHPNTDLTSKAMRPSATFNAALAPL

Ligand information Ligand ID MN InChI InChI=1S/Mn/q+2 InChIKey WAEMQWOKJMHJLA-UHFFFAOYSA-N SMILES Software SMILES ACDLabs 10.04 OpenEye OEToolkits 1.5.0 [Mn+2] CACTVS 3.341 [Mn++] Formula Mn Name MANGANESE (II) ION ChEMBL DrugBank DB06757 ZINC PDB chain 1itw Chain C Residue 742 [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 1itw Structure of the Monomeric Isocitrate Dehydrogenase: Evidence of a Protein Monomerization by a Domain Duplication Resolution 1.95 Å Binding residue (original residue number in PDB) D350 D548 Binding residue (residue number reindexed from 1) D349 D547 Annotation score 1

Enzymatic activity Enzyme Commision number 1.1.1.42: isocitrate dehydrogenase (NADP(+)).

Gene Ontology Molecular Function GO:0004450 isocitrate dehydrogenase (NADP+) activity GO:0016491 oxidoreductase activity GO:0046872 metal ion binding

	Biological Process
GO:0006097	glyoxylate cycle
GO:0006099	tricarboxylic acid cycle

	Cellular Component
GO:0005737	cytoplasm

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