eF-site ID 5oct-A PDB Code 5oct Chain A click to enlarge Title Discovery of small molecules binding to KRAS via high affinity antibody fragment competition method. Classification HYDROLASE Compound GTPase KRas Source (RASK_HUMAN) Sequence A:  YFQGMTEYKLVVVGAGGVGKSALTIQLIQNHFVDEYDPTI EDSYRKQVVIDGETXLLDILDTAGHEEYSAMRDQYMRTGE GFLCVFAINNTKSFEDIHHYREQIKRVKDSEDVPMVLVGN KCDLPSRTVDTKQAQDLARSYGIPFIETSAKTRQGVDDAF YTLVREIRKHKE Description Functional site 1) chain A residue 12 type sequence G description binding site for residue GNP A 201 source : AC1 2) chain A residue 13 type sequence G description binding site for residue GNP A 201 source : AC1 3) chain A residue 14 type sequence V description binding site for residue GNP A 201 source : AC1 4) chain A residue 15 type sequence G description binding site for residue GNP A 201 source : AC1 5) chain A residue 16 type sequence K description binding site for residue GNP A 201 source : AC1 6) chain A residue 17 type sequence S description binding site for residue GNP A 201 source : AC1 7) chain A residue 18 type sequence A description binding site for residue GNP A 201 source : AC1 8) chain A residue 28 type sequence F description binding site for residue GNP A 201 source : AC1 9) chain A residue 29 type sequence V description binding site for residue GNP A 201 source : AC1 10) chain A residue 30 type sequence D description binding site for residue GNP A 201 source : AC1 11) chain A residue 31 type sequence E description binding site for residue GNP A 201 source : AC1 12) chain A residue 32 type sequence Y description binding site for residue GNP A 201 source : AC1 13) chain A residue 34 type sequence P description binding site for residue GNP A 201 source : AC1 14) chain A residue 35 type sequence T description binding site for residue GNP A 201 source : AC1 15) chain A residue 60 type sequence G description binding site for residue GNP A 201 source : AC1 16) chain A residue 116 type sequence N description binding site for residue GNP A 201 source : AC1 17) chain A residue 117 type sequence K description binding site for residue GNP A 201 source : AC1 18) chain A residue 119 type sequence D description binding site for residue GNP A 201 source : AC1 19) chain A residue 120 type sequence L description binding site for residue GNP A 201 source : AC1 20) chain A residue 145 type sequence S description binding site for residue GNP A 201 source : AC1 21) chain A residue 146 type sequence A description binding site for residue GNP A 201 source : AC1 22) chain A residue 147 type sequence K description binding site for residue GNP A 201 source : AC1 23) chain A residue 61 type sequence H description binding site for residue 9R5 A 202 source : AC2 24) chain A residue 95 type sequence H description binding site for residue 9R5 A 202 source : AC2 25) chain A residue 96 type sequence Y description binding site for residue 9R5 A 202 source : AC2 26) chain A residue 99 type sequence Q description binding site for residue 9R5 A 202 source : AC2 27) chain A residue 142 type sequence I description binding site for residue PEG A 203 source : AC3 28) chain A residue 143 type sequence E description binding site for residue PEG A 203 source : AC3 29) chain A residue 150 type sequence Q description binding site for residue PEG A 203 source : AC3 30) chain A residue 151 type sequence G description binding site for residue PEG A 203 source : AC3 31) chain A residue 154 type sequence D description binding site for residue PEG A 203 source : AC3 32) chain A residue 17 type sequence S description binding site for residue MG A 204 source : AC4 33) chain A residue 35 type sequence T description binding site for residue MG A 204 source : AC4 34) chain A residue 105 type sequence D description binding site for residue 9R5 F 203 source : AE3 35) chain A residue 10 type BINDING sequence G description BINDING => ECO:0000269|PubMed:22431598, ECO:0000269|PubMed:22566140 source Swiss-Prot : SWS_FT_FI1 36) chain A residue 29 type BINDING sequence V description BINDING => ECO:0000269|PubMed:22431598, ECO:0000269|PubMed:22566140 source Swiss-Prot : SWS_FT_FI1 37) chain A residue 59 type BINDING sequence A description BINDING => ECO:0000269|PubMed:22431598, ECO:0000269|PubMed:22566140 source Swiss-Prot : SWS_FT_FI1 38) chain A residue 116 type BINDING sequence N description BINDING => ECO:0000269|PubMed:22431598, ECO:0000269|PubMed:22566140 source Swiss-Prot : SWS_FT_FI1 39) chain A residue 1 type MOD_RES sequence M description N-acetylmethionine; in GTPase KRas; alternate => ECO:0000269|Ref.17 source Swiss-Prot : SWS_FT_FI2 40) chain A residue 2 type MOD_RES sequence T description N-acetylthreonine; in GTPase KRas, N-terminally processed => ECO:0000269|Ref.17 source Swiss-Prot : SWS_FT_FI3 41) chain A residue 104 type MOD_RES sequence K description N6-acetyllysine => ECO:0000269|PubMed:22711838 source Swiss-Prot : SWS_FT_FI4 42) chain A residue 35 type CARBOHYD sequence T description (Microbial infection) O-linked (Glc) threonine; by P.sordellii toxin TcsL => ECO:0000269|PubMed:19744486 source Swiss-Prot : SWS_FT_FI5

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