eF-site ID 4x6h-A PDB Code 4x6h Chain A click to enlarge Title Development of N-(Functionalized benzoyl)-homocycloleucyl-glycinonitriles as Potent Cathepsin K Inhibitors. Classification HYDROLASE Compound Cathepsin K Source Homo sapiens (Human) (CATK_HUMAN) Sequence A:  APDSVDYRKKGYVTPVKNQGQCGSCWAFSSVGALEGQLKK KTGKLLNLSPQNLVDCVSENDGCGGGYMTNAFQYVQKNRG IDSEDAYPYVGQEESCMYNPTGKAAKCRGYREIPEGNEKA LKRAVARVGPVSVAIDASLTSFQFYSKGVYYDESCNSDNL NHAVLAVGYGIQKGNKHWIIKNSWGENWGNKGYILMARNK NNACGIANLASFPKM Description Functional site 1) chain A residue 19 type sequence Q description binding site for residue 3XT A 301 source : AC1 2) chain A residue 23 type sequence G description binding site for residue 3XT A 301 source : AC1 3) chain A residue 24 type sequence S description binding site for residue 3XT A 301 source : AC1 4) chain A residue 25 type sequence C description binding site for residue 3XT A 301 source : AC1 5) chain A residue 26 type sequence W description binding site for residue 3XT A 301 source : AC1 6) chain A residue 61 type sequence D description binding site for residue 3XT A 301 source : AC1 7) chain A residue 64 type sequence G description binding site for residue 3XT A 301 source : AC1 8) chain A residue 65 type sequence G description binding site for residue 3XT A 301 source : AC1 9) chain A residue 66 type sequence G description binding site for residue 3XT A 301 source : AC1 10) chain A residue 67 type sequence Y description binding site for residue 3XT A 301 source : AC1 11) chain A residue 117 type sequence N description binding site for residue 3XT A 301 source : AC1 12) chain A residue 118 type sequence E description binding site for residue 3XT A 301 source : AC1 13) chain A residue 119 type sequence K description binding site for residue 3XT A 301 source : AC1 14) chain A residue 134 type sequence A description binding site for residue 3XT A 301 source : AC1 15) chain A residue 161 type sequence N description binding site for residue 3XT A 301 source : AC1 16) chain A residue 199 type sequence N description binding site for residue 3XT A 301 source : AC1 17) chain A residue 23 type sequence G description binding site for residue I37 A 302 source : AC2 18) chain A residue 25 type sequence C description binding site for residue I37 A 302 source : AC2 19) chain A residue 26 type sequence W description binding site for residue I37 A 302 source : AC2 20) chain A residue 64 type sequence G description binding site for residue I37 A 302 source : AC2 21) chain A residue 65 type sequence G description binding site for residue I37 A 302 source : AC2 22) chain A residue 66 type sequence G description binding site for residue I37 A 302 source : AC2 23) chain A residue 117 type sequence N description binding site for residue I37 A 302 source : AC2 24) chain A residue 161 type sequence N description binding site for residue I37 A 302 source : AC2 25) chain A residue 67 type sequence Y description binding site for residue SO4 A 303 source : AC3 26) chain A residue 70 type sequence N description binding site for residue SO4 A 303 source : AC3 27) chain A residue 176 type sequence K description binding site for residue SO4 A 303 source : AC3 28) chain A residue 187 type sequence N description binding site for residue SO4 A 303 source : AC3 29) chain A residue 199 type sequence N description binding site for residue SO4 A 303 source : AC3 30) chain A residue 1 type sequence A description binding site for residue SO4 A 304 source : AC4 31) chain A residue 119 type sequence K description binding site for residue SO4 A 304 source : AC4 32) chain A residue 123 type sequence R description binding site for residue SO4 A 304 source : AC4 33) chain A residue 67 type sequence Y description binding site for residue SO4 A 305 source : AC5 34) chain A residue 119 type sequence K description binding site for residue SO4 A 305 source : AC5 35) chain A residue 122 type sequence K description binding site for residue SO4 A 305 source : AC5 36) chain A residue 176 type sequence K description binding site for residue SO4 A 305 source : AC5 37) chain A residue 198 type sequence R description binding site for residue SO4 A 305 source : AC5 38) chain A residue 199 type sequence N description binding site for residue SO4 A 305 source : AC5 39) chain A residue 18 type sequence N description binding site for residue SO4 A 306 source : AC6 40) chain A residue 77 type sequence K description binding site for residue SO4 A 306 source : AC6 41) chain A residue 185 type sequence G description binding site for residue SO4 A 306 source : AC6 42) chain A residue 186 type sequence E description binding site for residue SO4 A 306 source : AC6 43) chain A residue 187 type sequence N description binding site for residue SO4 A 306 source : AC6 44) chain A residue 110 type sequence Y description binding site for residue SO4 A 307 source : AC7 45) chain A residue 111 type sequence R description binding site for residue SO4 A 307 source : AC7 46) chain A residue 112 type sequence E description binding site for residue SO4 A 307 source : AC7 47) chain A residue 147 type sequence K description binding site for residue SO4 A 307 source : AC7 48) chain A residue 190 type sequence N description binding site for residue SO4 A 307 source : AC7 49) chain A residue 191 type sequence K description binding site for residue SO4 A 307 source : AC7 50) chain A residue 76 type sequence Q description binding site for residue SO4 A 308 source : AC8 51) chain A residue 108 type sequence R description binding site for residue SO4 A 308 source : AC8 52) chain A residue 109 type sequence G description binding site for residue SO4 A 308 source : AC8 53) chain A residue 110 type sequence Y description binding site for residue SO4 A 308 source : AC8 54) chain A residue 191 type sequence K description binding site for residue SO4 A 308 source : AC8 55) chain A residue 214 type sequence K description binding site for residue SO4 A 308 source : AC8 56) chain A residue 25 type ACT_SITE sequence C description ACT_SITE => ECO:0000250 source Swiss-Prot : SWS_FT_FI1 57) chain A residue 162 type ACT_SITE sequence H description ACT_SITE => ECO:0000250 source Swiss-Prot : SWS_FT_FI1 58) chain A residue 182 type ACT_SITE sequence N description ACT_SITE => ECO:0000250 source Swiss-Prot : SWS_FT_FI1 59) chain A residue 19-30 type prosite sequence QGQCGSCWAFSS description THIOL_PROTEASE_CYS Eukaryotic thiol (cysteine) proteases cysteine active site. QGqCGSCWAfSS source prosite : PS00139 60) chain A residue 160-170 type prosite sequence LNHAVLAVGYG description THIOL_PROTEASE_HIS Eukaryotic thiol (cysteine) proteases histidine active site. LNHAVLAVGYG source prosite : PS00639 61) chain A residue 177-196 type prosite sequence HWIIKNSWGENWGNKGYILM description THIOL_PROTEASE_ASN Eukaryotic thiol (cysteine) proteases asparagine active site. HWIiKNSWgenWGnkGYIlM source prosite : PS00640

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