2024-01-06_00000078|ligand|8FOR

Crystal Structure of Kemp Eliminase KE70-core with bound transition state analogue; X-ray diffraction 2.20Å

Protein #1 270 residues (92% resolved)

Raw Sequence ...

TDLKASSLRALKLMHLATSANDDDTDEKVIALCHQAKTPVGTTDAIFIYPRFIPIARKTLKEQGTPEIRICTSTNFPHGNDDIDIALAETRAAIAYGADSVAVVFPYRALMAGNEQVGFDLVKACKEACAAANVLLAVIIETGELKDEALIRKASEISIKAGADNIVTSTGKVAVGATPESARIMMEVIRDMGVEKTVGFIPVGGVRTAEDAQKYLAIADELFGADWADARHYAFGASASLLASLLKALGHGDGKSASSYGSLEHHHHHH

Canonical Sequence ...

Non polymer #2 6NT

InChI=1S/C6H4N4O2/c11-10(12)4-1-2-5-6(3-4)8-9-7-5/h1-3H,(H,7,8,9)

SMILES: c1cc2c(cc1[N+](=O)[O-])[nH]nn2

c1cc2c(cc1[N+](=O)[O-])[nH]nn2

Reference