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MolNFT v1 · #146180 · protein

Structure of cysz, a sulfate permease from pseudomonas denitrificans

6D9Z · Sulfate transporter cysz: “Structure of cysz, a sulfate permease from pseudomonas denitrificans”. X-ray diffraction, 20 pockets (best druggability 0.84). MolNFT v1 #146180 on GenesisL1: 3D structure, binding sites and pockets in…

PDB
6D9Z
Type
protein
Length
1,433 residues
Chains
6
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Sulfate transporter cysz
UniProt
M4XKU7
Pockets
20 · best druggability 0.84

Structure

x-ray diffraction · 3 distinct chains · 81% helix, 0% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
F, D, ESulfate transporter cyszprotein24080% helix, 0% strandM4XKU7
A, BSulfate transporter cyszprotein23682% helix, 0% strandM4XKU7
CSulfate transporter cyszprotein24181% helix, 0% strandM4XKU7

Ligands and binding sites

  • BOG · octyl beta-D-glucopyranoside · additive · 20 copies · chains F, A, D, B, C, E

Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.

Pockets

20 pockets found on a 1 Å grid, 14 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
18850.840.8594BOG
28060.820.8498BOG
38230.800.8266BOG
47260.780.8270BOG
53140.700.8239empty

Interfaces

12 interfaces between chains.

  • C–E · 747 Ų buried · 2 hydrogen bonds · protein-protein
  • D–E · 721 Ų buried · 0 hydrogen bonds · protein-protein
  • A–B · 715 Ų buried · 2 hydrogen bonds · protein-protein
  • B–C · 712 Ų buried · 0 hydrogen bonds · protein-protein
  • F–A · 693 Ų buried · 0 hydrogen bonds · protein-protein

Compared structures

  • 6D9Z · Structure of CysZ, a sulfate permease from Pseudomonas Denitrificans · the same entry in another collection · chain F against F, TM-score 1.00

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