8HOA

ScRIPK mutant K124R

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A	Hypothetical protein	polymer	326	36204.3	1	UniProt (A0A811MC32) Pfam (PF07714) In PDB	Saccharum hybrid cultivar
2	A	ADENOSINE-5'-TRIPHOSPHATE	non-polymer		507.2	1	Chemie (ATP)
3	A	(2R,5R)-hexane-2,5-diol	non-polymer		118.2	1	Chemie (HX2)
4	A	FORMIC ACID	non-polymer		46.0	4	Chemie (FMT)
5		water	water		18.0	227	Chemie (HOH)

Sequence modifications

A: -1 - 309 (UniProt: A0A811MC32)

PDB	External Database	Details
Met -16	-	initiating methionine
Gly -15	-	expression tag
Ser -14	-	expression tag
Ser -13	-	expression tag
His -12	-	expression tag
His -11	-	expression tag
His -10	-	expression tag
His -9	-	expression tag
His -8	-	expression tag
His -7	-	expression tag
Ser -6	-	expression tag
Gln -5	-	expression tag
Gly -4	-	expression tag
Ser -3	-	expression tag
Met -2	-	expression tag
His 40	Asp 126	conflict
Thr 51	Ser 137	conflict
Arg 55	Lys 141	conflict
Gln 69	Leu 155	conflict
Gly 106	Val 192	conflict
Tyr 213	Phe 299	conflict
Thr 230	Ser 316	conflict
Pro 233	Ala 319	conflict
Ser 259	Ala 345	conflict
Thr 266	Ser 352	conflict

Contents of the asymmetric unit

Polymers	Number of chains	1
	Total formula weight	36204.3
Non-Polymers*	Number of molecules	6
	Total formula weight	809.5
All*	Total formula weight	37013.8

*Water molecules are not included.