MolNFT v1 · #163340 · protein

Carbonic anhydrase caix mimic in complex with inhibitor I39LT379

6S03: “Carbonic anhydrase caix mimic in complex with inhibitor I39LT379”. X-ray diffraction, 2 ligands (KPW, ZN). MolNFT v1 #163340 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB: 6S03
Type: protein
Length: 257 residues
Chains: 1
Method: x-ray diffraction
Collection: MolNFT v1 / PDB
Contract: 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner: 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
UniProt: P00918
Ligands: KPW, ZN

Structure

x-ray diffraction · 1 distinct chain.

Chain	Molecule	Type	Residues	Secondary structure	UniProt
A	—	protein	257	—	P00918

Ligands and binding sites

KPW · 4-[[4-[5,5-dimethyl-2-(6-methylpyridin-2-yl)-4,6-dihydropyrrolo[1,2-b]pyrazol-3-yl]pyridin-2-yl]amino]benzenesulfonamide · ligand · chains A
ZN · Zinc ion · metal · chains A

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

Compared structures

6S03 · Carbonic Anhydrase CAIX mimic in complex with inhibitor I39LT379 · the same entry in another collection · chain A against A, TM-score 1.00
P00918 · AlphaFold monomer V2.0 prediction for carbonic anhydrase 2 (P00918) · a predicted model of the same protein · chain A against A, TM-score 1.00

Analyse

Open in the research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides and crosslinks on the 3D structure
Every structure of UniProt P00918
Elsewhere: RCSB PDB 6S03 · PDBe 6S03 · UniProt P00918

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