I have a large molecule to refine.There are about three thousand residues in
one asymmetric unit.
Except for the lack of electron densities in several places, where the
loops have been deleted, the rest parts fits well with density. But the R free
and R work are all beyond 0.30 (R free = 0.35,
The space group is P212121
There are four chains in one asymmetric unit: two A chains and two B chains.
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Dear all,
Thanks for all replies.
After water addition, R work is 0.27 and R free 0.33.
TLS and NCS results no significant approve.
Space group seem right, other space group like P21212 is worse.
>From truncate result, it is not twinning.
More detail is below:
space group P212121 a=150.099 b=148.