PDB Bank怎么下载小分子sdf(选择哪个)和复合物
比如这个复合物:
RCSB PDB - 7U8H: Discovery of a KRAS G12V Inhibitor in vivo Tool Compound starting from an HSQC-NMR based Fragment Hit
配体小分子有好几个,到底选哪个?
并且点击下载以后不知道选择哪个sdf(因为存在多个chain)
比如这个复合物:
RCSB PDB - 7U8H: Discovery of a KRAS G12V Inhibitor in vivo Tool Compound starting from an HSQC-NMR based Fragment Hit
配体小分子有好几个,到底选哪个?
并且点击下载以后不知道选择哪个sdf(因为存在多个chain)