8HXJ

BANAL-20-52 Spike trimer

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	1286	142380.4	3	UniProt (P0DTC2) Pfam (PF16451) Pfam (PF09408) Pfam (PF19209) Pfam (PF01601)	unclassified Coronavirinae	S glycoprotein,E2,Peplomer protein
2	AA, D, E, F, G... (a, D, E, F, G...)	2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose	branched		424.4	24	In PDB GlyTouCan (G42666HT)
3	AB, BA, BB, CA, CB... (C, A, B)	2-acetamido-2-deoxy-beta-D-glucopyranose	non-polymer		221.2	33	Chemie (NAG)

Sequence modifications

A, B, C: 1 - 1204 (UniProt: P0DTC2)

PDB	External Database	Details
Ser 32	Phe 32	conflict
Leu 50	Ser 50	conflict
Ile 76	Thr 76	variant
Arg 147	Lys 147	conflict
Pro 218	Gln 218	conflict
Ser 292	Ala 292	conflict
Thr 346	Arg 346	conflict
Thr 372	Ala 372	conflict
Val 402	Ile 402	conflict
His 498	Gln 498	conflict
Asn 519	His 519	conflict
Ile 534	Val 534	conflict
Ala 604	Thr 604	conflict
Asn 627	Asp 627	conflict
-	Pro 681	deletion
-	Arg 682	deletion
-	Arg 683	deletion
-	Ala 684	deletion
Gln 789	Pro 793	conflict
Pro 982	Lys 986	conflict
Pro 983	Val 987	conflict
Ser 1163	Gly 1167	conflict
Leu 1205	-	expression tag
Glu 1206	-	expression tag
Gly 1207	-	expression tag
Ser 1208	-	expression tag
Gly 1209	-	expression tag
Tyr 1210	-	expression tag
Ile 1211	-	expression tag
Pro 1212	-	expression tag
Glu 1213	-	expression tag
Ala 1214	-	expression tag
Pro 1215	-	expression tag
Arg 1216	-	expression tag
Asp 1217	-	expression tag
Gly 1218	-	expression tag
Gln 1219	-	expression tag
Ala 1220	-	expression tag
Tyr 1221	-	expression tag
Val 1222	-	expression tag
Arg 1223	-	expression tag
Lys 1224	-	expression tag
Asp 1225	-	expression tag
Gly 1226	-	expression tag
Glu 1227	-	expression tag
Trp 1228	-	expression tag
Val 1229	-	expression tag
Leu 1230	-	expression tag
Leu 1231	-	expression tag
Ser 1232	-	expression tag
Thr 1233	-	expression tag
Phe 1234	-	expression tag
Leu 1235	-	expression tag
Gly 1236	-	expression tag
Arg 1237	-	expression tag
Ser 1238	-	expression tag
Leu 1239	-	expression tag
Glu 1240	-	expression tag
Val 1241	-	expression tag
Leu 1242	-	expression tag
Phe 1243	-	expression tag
Gln 1244	-	expression tag
Gly 1245	-	expression tag
Pro 1246	-	expression tag
Gly 1247	-	expression tag
His 1248	-	expression tag
His 1249	-	expression tag
His 1250	-	expression tag
His 1251	-	expression tag
His 1252	-	expression tag
His 1253	-	expression tag
His 1254	-	expression tag
His 1255	-	expression tag
Ser 1256	-	expression tag
Ala 1257	-	expression tag
Trp 1258	-	expression tag
Ser 1259	-	expression tag
His 1260	-	expression tag
Pro 1261	-	expression tag
Gln 1262	-	expression tag
Phe 1263	-	expression tag
Glu 1264	-	expression tag
Lys 1265	-	expression tag
Gly 1266	-	expression tag
Gly 1267	-	expression tag
Gly 1268	-	expression tag
Ser 1269	-	expression tag
Gly 1270	-	expression tag
Gly 1271	-	expression tag
Gly 1272	-	expression tag
Gly 1273	-	expression tag
Ser 1274	-	expression tag
Gly 1275	-	expression tag
Gly 1276	-	expression tag
Ser 1277	-	expression tag
Ala 1278	-	expression tag
Trp 1279	-	expression tag
Ser 1280	-	expression tag
His 1281	-	expression tag
Pro 1282	-	expression tag
Gln 1283	-	expression tag
Phe 1284	-	expression tag
Glu 1285	-	expression tag
Lys 1286	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	3
	Total formula weight	427141.2
Branched	Number of molecules	24
	Total formula weight	10185.6
Non-Polymers*	Number of molecules	33
	Total formula weight	7299.9
All*	Total formula weight	444626.7

*Water molecules are not included.