7X08

S protein of SARS-CoV-2 in complex with 2G1

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A, B, C (A, B, C)	Spike glycoprotein	polymer	1283	142530.7	3	UniProt (P0DTC2) Pfam (PF16451) Pfam (PF09408) Pfam (PF19209) Pfam (PF01601)	Severe acute respiratory syndrome coronavirus (2019-nCoV SARS-CoV-2)	S glycoprotein,E2,Peplomer protein
2	D, F, H (H, I, J)	heavy chain of 2G1	polymer	452	49458.8	3		Homo sapiens (human)
3	E, G, I (L, M, N)	light chain of 2G1	polymer	216	22593.8	3		Homo sapiens (human)
4	AA, BA, CA, DA, EA... (a, b, c, d, e...)	2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose	branched		424.4	24	In PDB GlyTouCan (G42666HT)
5	AB, BB, CB, EB, FB... (B, C, A)	2-acetamido-2-deoxy-beta-D-glucopyranose	non-polymer		221.2	30	Chemie (NAG)
6	DB, RA, SA (B, A)	LINOLEIC ACID	non-polymer		280.4	3	Chemie (EIC)

Sequence modifications

A, B, C: 1 - 1273 (UniProt: P0DTC2)

PDB	External Database	Details
Pro 817	Phe 817	engineered mutation
Pro 892	Ala 892	engineered mutation
Pro 899	Ala 899	engineered mutation
Pro 942	Ala 942	engineered mutation
Pro 986	Lys 986	engineered mutation
Pro 987	Val 987	engineered mutation
Leu 1274	-	expression tag
Glu 1275	-	expression tag
Asp 1276	-	expression tag
Tyr 1277	-	expression tag
Lys 1278	-	expression tag
Asp 1279	-	expression tag
Asp 1280	-	expression tag
Asp 1281	-	expression tag
Asp 1282	-	expression tag
Lys 1283	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	9
	Total formula weight	643749.7
Branched	Number of molecules	24
	Total formula weight	10185.6
Non-Polymers*	Number of molecules	33
	Total formula weight	7477.6
All*	Total formula weight	661412.9

*Water molecules are not included.