eF-site ID 3du8-AB PDB Code 3du8 Chain A, B click to enlarge Title Crystal structure of GSK-3 beta in complex with NMS-869553A Classification TRANSFERASE Compound Glycogen synthase kinase-3 beta Source Homo sapiens (Human) (GSK3B_HUMAN) Sequence A:  SKVTTVVATPGQGPDRPQEVSYTDTKVIGNGSFGVVYQAK LCDSGELVAIKKVLQDKRFKNRELQIMRKLDHCNIVRLRY FFYSSVYLNLVLDYVPETVYRVARHYSRAKQTLPVIYVKL YMYQLFRSLAYIHSFGICHRDIKPQNLLLDPDTAVLKLCD FGSAKQLVRGEPNVSYICSRYYRAPELIFGATDYTSSIDV WSAGCVLAELLLGQPIFPGDSGVDQLVEIIKVLGTPTREQ IREMNPFPQIKAHPWTKVFRPRTPPEAIALCSRLLEYTPT ARLTPLEACAHSFFDELRDPNVKLPNGRDTPALFNFTTQE LSSNPPLATILIPPHA B:  SKVTTVVATPGQGPDRPQEVSYTDTKVIGNGSFGVVYQAK LCDSGELVAIKKVLQDKRFKNRELQIMRKLDHCNIVRLRY FFYSSVYLNLVLDYVPETVYRVARHYSRAKQTLPVIYVKL YMYQLFRSLAYIHSFGICHRDIKPQNLLLDPDTAVLKLCD FGSAKQLVRGEPNVSYICSRYYRAPELIFGATDYTSSIDV WSAGCVLAELLLGQPIFPGDSGVDQLVEIIKVLGTPTREQ IREMNPFPQIKAHPWTKVFRPRTPPEAIALCSRLLEYTPT ARLTPLEACAHSFFDELRDPNVKLPNGRDTPALFNFTTQE LSSNPPLATILIPPHARIQ Description Functional site 1) chain A residue 67 type sequence F description BINDING SITE FOR RESIDUE 553 A 553 source : AC1 2) chain A residue 83 type sequence A description BINDING SITE FOR RESIDUE 553 A 553 source : AC1 3) chain A residue 85 type sequence K description BINDING SITE FOR RESIDUE 553 A 553 source : AC1 4) chain A residue 133 type sequence D description BINDING SITE FOR RESIDUE 553 A 553 source : AC1 5) chain A residue 134 type sequence Y description BINDING SITE FOR RESIDUE 553 A 553 source : AC1 6) chain A residue 186 type sequence N description BINDING SITE FOR RESIDUE 553 A 553 source : AC1 7) chain A residue 188 type sequence L description BINDING SITE FOR RESIDUE 553 A 553 source : AC1 8) chain A residue 200 type sequence D description BINDING SITE FOR RESIDUE 553 A 553 source : AC1 9) chain B residue 83 type sequence A description BINDING SITE FOR RESIDUE 553 B 553 source : AC2 10) chain B residue 85 type sequence K description BINDING SITE FOR RESIDUE 553 B 553 source : AC2 11) chain B residue 133 type sequence D description BINDING SITE FOR RESIDUE 553 B 553 source : AC2 12) chain B residue 134 type sequence Y description BINDING SITE FOR RESIDUE 553 B 553 source : AC2 13) chain B residue 186 type sequence N description BINDING SITE FOR RESIDUE 553 B 553 source : AC2 14) chain B residue 188 type sequence L description BINDING SITE FOR RESIDUE 553 B 553 source : AC2 15) chain B residue 200 type sequence D description BINDING SITE FOR RESIDUE 553 B 553 source : AC2 16) chain A residue 62-86 type prosite sequence IGNGSFGVVYQAKLCDSGELVAIKK description PROTEIN_KINASE_ATP Protein kinases ATP-binding region signature. IGNGSFGVVYqAklcdsgelv.........AIKK source prosite : PS00107 17) chain A residue 177-189 type prosite sequence ICHRDIKPQNLLL description PROTEIN_KINASE_ST Serine/Threonine protein kinases active-site signature. IcHrDIKpqNLLL source prosite : PS00108 18) chain A residue 181 type ACT_SITE sequence D description Proton acceptor source Swiss-Prot : SWS_FT_FI1 19) chain B residue 181 type ACT_SITE sequence D description Proton acceptor source Swiss-Prot : SWS_FT_FI1 20) chain A residue 62 type BINDING sequence I description BINDING => ECO:0000255|PROSITE-ProRule:PRU00159 source Swiss-Prot : SWS_FT_FI2 21) chain B residue 62 type BINDING sequence I description BINDING => ECO:0000255|PROSITE-ProRule:PRU00159 source Swiss-Prot : SWS_FT_FI2 22) chain A residue 85 type BINDING sequence K description BINDING => ECO:0000255|PROSITE-ProRule:PRU00159, ECO:0000305|PubMed:17050006 source Swiss-Prot : SWS_FT_FI3 23) chain B residue 85 type BINDING sequence K description BINDING => ECO:0000255|PROSITE-ProRule:PRU00159, ECO:0000305|PubMed:17050006 source Swiss-Prot : SWS_FT_FI3 24) chain A residue 216 type MOD_RES sequence Y description Phosphotyrosine => ECO:0000269|PubMed:12554650, ECO:0000269|PubMed:25169422 source Swiss-Prot : SWS_FT_FI5 25) chain B residue 216 type MOD_RES sequence Y description Phosphotyrosine => ECO:0000269|PubMed:12554650, ECO:0000269|PubMed:25169422 source Swiss-Prot : SWS_FT_FI5

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