Structure analysis

Sodium pumping NADH-quinone oxidoreductase with substrate Q2

Electron Microscopy
2.73Å resolution
Source organism: Vibrio cholerae
Assembly composition:
hetero hexamer (preferred)
Entry contents: 6 distinct polypeptide molecules

Assemblies

Assembly 1 (preferred)
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Multimeric state: hetero hexamer
Accessible surface area: 73167.84 Å2
Buried surface area: 29558.5 Å2
Dissociation area: 1,936.65 Å2
Dissociation energy (ΔGdiss): 23.28 kcal/mol
Dissociation entropy (TΔSdiss): 15.48 kcal/mol
Symmetry number: 1
PDBe Complex ID: PDB-CPX-107567

Macromolecules

Chain: A
Length: 468 amino acids
Theoretical weight: 51.13 KDa
Source organism: Vibrio cholerae
Expression system: Vibrio cholerae
UniProt:
  • Canonical: A5F5X1 (Residues: 1-446; Coverage: 100%)
Gene names: VC0395_A1884, VC395_2411, nqrA
Pfam:
PDBe-KB: UniProt Coverage View: A5F5X1  
146850100150200250300350400450
 
200400MGSSHHHHHHSSGLEVLFQGPHMITIKKGLDLPIAGTPSQVISDGKAIKKVALLGEEYVGMRPTMHVRVGDEVKKAQILFEDKKNPGVKFTSPVSGKVVEINRGAKRVLQSVVIEVAGDDQVTFDKFEANQLASLNRDAIKTQLVESGLWTAFRTRPFSKVPAIDSTSEAIFVTAMDTNPLAAEPTVVINEQSEAFVAGLDVLSALTTGKVYVCKKGTSLPRSQQPNVEEHVFDGPHPAGLAGTHMHFLYPVSADHVAWSINYQDVIAVGQLFLTGELYTQRVVSLAGPVVNKPRLVRTVMGASLEQLVDSEIMPGEVRIISGSVLSGTKATGPHAYLGRYHLQVSVLREGRDKELFGWAMPGKNKFSVTRSFLGHLFKGQVYNMTTTTNGSDRSMVPIGNYEKVMPLDMEPTLLLRDLCAGDSDSAVRLGALELDEEDLALCTFVCPGKYEYGQLLRECLDKIEKEG
UniProt
A5F5X1
Chains
Secondary structure
Interaction interfaces
Sequence conservation

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Chain: B
Length: 415 amino acids
Theoretical weight: 45.39 KDa
Source organism: Vibrio cholerae
Expression system: Vibrio cholerae
UniProt:
  • Canonical: A5F5X0 (Residues: 1-415; Coverage: 100%)
Gene names: VC0395_A1883, VC395_2410, nqrB
Pfam: NQR2, RnfD, RnfE family
PDBe-KB: UniProt Coverage View: A5F5X0  
141550100150200250300350400
 
100200300400MGLKKFLEDIEHHFEPGGKHEKWFALYEAAATLFYTPGLVTKRSSHVRDSVDLKRIMIMVWLAVFPAMFWGMYNAGGQAIAALNHLYSGDQLAAIVAGNWHYWLTEMLGGTMSSDAGWGSKMLLGATYFLPIYATVFIVGGFWEVLFCMVRKHEVNEGFFVTSILFALIVPPTLPLWQAALGITFGVVVAKEVFGGTGRNFLNPALAGRAFLFFAYPAQISGDLVWTAADGYSGATALSQWAQGGAGALINNATGQTITWMDAFIGNIPGSIGEVSTLALMIGAAFIVYMGIASWRIIGGVMIGMILLSTLFNVIGSDTNAMFNMPWHWHLVLGGFAFGMFFMATDPVSASFTNSGKWAYGILIGVMCVLIRVVNPAYPEGMMLAILFANLFAPLFDHVVVERNIKRRLARYGKQ
UniProt
A5F5X0
Chains
Secondary structure
Ligand binding sites
Interaction interfaces
Sequence conservation

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Chain: C
Length: 257 amino acids
Theoretical weight: 27.65 KDa
Source organism: Vibrio cholerae
Expression system: Vibrio cholerae
UniProt:
  • Canonical: A5F5Y7 (Residues: 1-257; Coverage: 100%)
Gene names: VC0395_A1882, VC395_2409, nqrC
Pfam: FMN-binding domain
PDBe-KB: UniProt Coverage View: A5F5Y7  
125720406080100120140160180200220240
 
100200MASNNDSIKKTLFVVIALSLVCSIIVSAAAVGLRDKQKENAALDKQSKILQVAGIEAKGSKQIVELFNKSIEPRLVDFNTGDFVEGDAANYDQRKAAKEASESIKLTAEQDKAKIQRRANVGVVYLVKDGDKTSKVILPVHGNGLWSMMYAFVAVETDGNTVSGLTYYEQGETPGLGGEVENPAWRAQWVGKKLFDENHKPAIKIVKGGAPQGSEHGVDGLSGATLTSNGVQNTFDFWLGDMGFGPFLTKVRDGGLN
UniProt
A5F5Y7
Chains
Secondary structure
Ligand binding sites
Interaction interfaces
Sequence conservation

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Chain: D
Length: 210 amino acids
Theoretical weight: 22.85 KDa
Source organism: Vibrio cholerae
Expression system: Vibrio cholerae
UniProt:
  • Canonical: A5F5Y6 (Residues: 1-210; Coverage: 100%)
Gene names: VC0395_A1881, VC395_2408, nqrD
Pfam: Rnf-Nqr subunit, membrane protein
PDBe-KB: UniProt Coverage View: A5F5Y6  
121020406080100120140160180200
 
50100150200MSSAKELKKSVLAPVLDNNPIALQVLGVCSALAVTTKLETAFVMTLAVMFVTALSNFFVSLIRNHIPNSVRIIVQMAIIASLVIVVDQILKAYLYDISKQLSVFVGLIITNCIVMGRAEAFAMKSEPIPSFIDGIGNGLGYGFVLMTVGFFRELLGSGKLFGLEVLPLISNGGWYQPNGLMLLAPSAFFLIGFMIWAIRTFKPEQVEAKE
UniProt
A5F5Y6
Chains
Secondary structure
Ligand binding sites
Interaction interfaces
Sequence conservation

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Chain: E
Length: 198 amino acids
Theoretical weight: 21.48 KDa
Source organism: Vibrio cholerae
Expression system: Vibrio cholerae
UniProt:
  • Canonical: A5F5Y5 (Residues: 1-198; Coverage: 100%)
Gene names: VC0395_A1880, VC395_2407, nqrE
Pfam: Rnf-Nqr subunit, membrane protein
PDBe-KB: UniProt Coverage View: A5F5Y5  
119820406080100120140160180
 
50100150MEHYISLLVKSIFIENMALSFFLGMCTFLAVSKKVKTSFGLGIAVIVVLTISVPVNNLVYNLVLKPDALVEGVDLSFLNFITFIGVIAALVQILEMILDRFFPPLYNALGIFLPLITVNCAIFGGVSFMVQRDYSFAESVVYGFGSGVGWMLAIVALAGIREKMKYSDVPPGLRGLGITFITAGLMALGFMSFSGVQL
UniProt
A5F5Y5
Chains
Secondary structure
Ligand binding sites
Interaction interfaces
Sequence conservation

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Chain: F
Length: 408 amino acids
Theoretical weight: 45.11 KDa
Source organism: Vibrio cholerae
Expression system: Vibrio cholerae
UniProt:
  • Canonical: A5F5Y4 (Residues: 1-408; Coverage: 100%)
Gene names: VC0395_A1879, VC395_2406, nqrF
Pfam:
PDBe-KB: UniProt Coverage View: A5F5Y4  
140850100150200250300350400
 
100200300400MSTIIFGVVMFTLIILALVLVILFAKSKLVPTGDITISINGDPEKAIVTQPGGKLLTALAGAGVFVSSACGGGGSCGQCRVKIKSGGGDILPTELDHISKGEAREGERLACQVAVKADMDLELPEEIFGVKKWECTVISNDNKATFIKELKLAIPDGESVPFRAGGYIQIEAPAHHVKYADFDVPEKYRGDWDKFNLFRYESKVDEPIIRAYSMANYPEEFGIIMLNVRIATPPPNNPNVPPGQMSSYIWSLKAGDKCTISGPFGEFFAKDTDAEMVFIGGGAGMAPMRSHIFDQLKRLKSKRKMSYWYGARSKREMFYVEDFDGLAAENDNFVWHCALSDPQPEDNWTGYTGFIHNVLYENYLKDHEAPEDCEYYMCGPPMMNAAVINMLKNLGVEEENILLDDFGG
UniProt
A5F5Y4
Chains
Secondary structure
Ligand binding sites
Interaction interfaces
Sequence conservation

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