ID 6NNVA STANDARD; PRT; 127 AA. DT CONVERTED FROM PDB (SEQRES) 6NNV DE Programmed cell death 1 ligand 1 OS Homo sapiens CC EXPDTA X-RAY DIFFRACTION CC RESOLU 1.920 CC R-Factor 0.218 FT #SUB 96 113 ARG A 73 90 ASP D Protein S 1 FT #SUB 106 123 TYR A 69 86 ARG D Protein S 1 FT #SUB 108 125 ARG A 73 90 ASP D Protein S 4 FT #SUB 5 22 THR A 3 3 MEA I Protein S 2 FT #SUB 37 54 ILE A 4 4 9KK J Protein S 1 FT #SUB 37 54 ILE A 7 7 VAL J Protein S 2 FT #SUB 37 54 ILE A 8 8 MEA J Protein A 2 FT #SUB 39 56 TYR A 2 2 PHE J Protein S 13 FT #SUB 39 56 TYR A 8 8 MEA J Protein S 1 FT #SUB 39 56 TYR A 12 12 TYR J Protein S 1 FT #SUB 39 56 TYR A 14 14 CYS J Protein S 1 FT #SUB 41 58 GLU A 12 12 TYR J Protein S 5 FT #SUB 41 58 GLU A 13 13 LEU J Protein S 7 FT #SUB 41 58 GLU A 14 14 CYS J Protein S 4 FT #SUB 43 60 GLU A 13 13 LEU J Protein B 2 FT #SUB 44 61 ASP A 13 13 LEU J Protein S 2 FT #SUB 44 61 ASP A 14 14 CYS J Protein B 1 FT #SUB 46 63 ASN A 1 1 ACE J Protein S 4 FT #SUB 49 66 GLN A 2 2 PHE J Protein S 6 FT #SUB 49 66 GLN A 3 3 MEA J Protein S 1 FT #SUB 51 68 VAL A 4 4 9KK J Protein S 2 FT #SUB 96 113 ARG A 11 11 TRP J Protein S 2 FT #SUB 98 115 MET A 8 8 MEA J Protein A 14 FT #SUB 98 115 MET A 11 11 TRP J Protein S 1 FT #SUB 98 115 MET A 12 12 TYR J Protein S 3 FT #SUB 99 116 ILE A 8 8 MEA J Protein B 7 FT #SUB 100 117 SER A 8 8 MEA J Protein A 3 FT #SUB 104 121 ALA A 11 11 TRP J Protein A 3 FT #SUB 105 122 ASP A 11 11 TRP J Protein B 8 FT #SUB 106 123 TYR A 11 11 TRP J Protein S 18 FT DISORDER 120 127 CC Miss-SC 2 CC SEQUENCE 119 AA (ATOM); CC AFTVTVPKDL YVVEYGSNMT IECKFPVEKQ LDLAALIVYW EMEDKNIIQF VHGEEDLKTQ CC HSSYRQRARL LKDQLSLGNA ALQITDVKLQ DAGVYRCMIS YGGADYKRIT VKVNAPYAA CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES AFTVTVPKDLYVVEYGSNMTIECKFPVEKQLDLAALIVYWEMEDKNIIQF CC ATOM AFTVTVPKDLYVVEYGSNMTIECKFPVEKQLDLAALIVYWEMEDKNIIQF CC ************************************************** CC SEQRES VHGEEDLKTQHSSYRQRARLLKDQLSLGNAALQITDVKLQDAGVYRCMIS CC ATOM VHGEEDLKTQHSSYRQRARLLKDQLSLGNAALQITDVKLQDAGVYRCMIS CC ************************************************** CC SEQRES YGGADYKRITVKVNAPYAAALHEHHHH CC ATOM YGGADYKRITVKVNAPYAA-------- CC ******************* SQ SEQUENCE 127 AA; MW; CN; AFTVTVPKDL YVVEYGSNMT IECKFPVEKQ LDLAALIVYW EMEDKNIIQF VHGEEDLKTQ HSSYRQRARL LKDQLSLGNA ALQITDVKLQ DAGVYRCMIS YGGADYKRIT VKVNAPYAAA LHEHHHH // ID 6NNVB STANDARD; PRT; 127 AA. DT CONVERTED FROM PDB (SEQRES) 6NNV DE Programmed cell death 1 ligand 1 OS Homo sapiens CC EXPDTA X-RAY DIFFRACTION CC RESOLU 1.920 CC R-Factor 0.218 FT #SUB 96 113 ARG B 73 90 ASP C Protein S 1 FT #SUB 106 123 TYR B 69 86 ARG C Protein S 1 FT #SUB 108 125 ARG B 73 90 ASP C Protein S 9 FT #SUB 37 54 ILE B 8 8 MEA I Protein B 1 FT #SUB 39 56 TYR B 2 2 PHE I Protein S 12 FT #SUB 39 56 TYR B 8 8 MEA I Protein S 1 FT #SUB 39 56 TYR B 12 12 TYR I Protein S 1 FT #SUB 39 56 TYR B 14 14 CYS I Protein S 1 FT #SUB 41 58 GLU B 12 12 TYR I Protein S 5 FT #SUB 41 58 GLU B 13 13 LEU I Protein S 7 FT #SUB 41 58 GLU B 14 14 CYS I Protein S 4 FT #SUB 43 60 GLU B 13 13 LEU I Protein B 2 FT #SUB 44 61 ASP B 13 13 LEU I Protein S 1 FT #SUB 44 61 ASP B 14 14 CYS I Protein B 3 FT #SUB 46 63 ASN B 1 1 ACE I Protein S 4 FT #SUB 49 66 GLN B 2 2 PHE I Protein S 5 FT #SUB 49 66 GLN B 3 3 MEA I Protein S 1 FT #SUB 49 66 GLN B 4 4 9KK I Protein S 2 FT #SUB 51 68 VAL B 4 4 9KK I Protein S 1 FT #SUB 59 76 THR B 1 1 ACE I Protein S 1 FT #SUB 96 113 ARG B 11 11 TRP I Protein S 2 FT #SUB 96 113 ARG B 13 13 LEU I Protein S 2 FT #SUB 98 115 MET B 8 8 MEA I Protein A 11 FT #SUB 98 115 MET B 11 11 TRP I Protein S 3 FT #SUB 98 115 MET B 12 12 TYR I Protein S 3 FT #SUB 99 116 ILE B 8 8 MEA I Protein B 3 FT #SUB 100 117 SER B 8 8 MEA I Protein A 4 FT #SUB 104 121 ALA B 11 11 TRP I Protein A 3 FT #SUB 105 122 ASP B 11 11 TRP I Protein B 7 FT #SUB 106 123 TYR B 11 11 TRP I Protein S 12 FT DISORDER 29 30 FT DISORDER 124 127 CC SEQUENCE 121 AA (ATOM); CC AFTVTVPKDL YVVEYGSNMT IECKFPVELD LAALIVYWEM EDKNIIQFVH GEEDLKTQHS CC SYRQRARLLK DQLSLGNAAL QITDVKLQDA GVYRCMISYG GADYKRITVK VNAPYAAALH CC E CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES AFTVTVPKDLYVVEYGSNMTIECKFPVEKQLDLAALIVYWEMEDKNIIQF CC ATOM AFTVTVPKDLYVVEYGSNMTIECKFPVE--LDLAALIVYWEMEDKNIIQF CC **************************** ******************** CC SEQRES VHGEEDLKTQHSSYRQRARLLKDQLSLGNAALQITDVKLQDAGVYRCMIS CC ATOM VHGEEDLKTQHSSYRQRARLLKDQLSLGNAALQITDVKLQDAGVYRCMIS CC ************************************************** CC SEQRES YGGADYKRITVKVNAPYAAALHEHHHH CC ATOM YGGADYKRITVKVNAPYAAALHE---- CC *********************** SQ SEQUENCE 127 AA; MW; CN; AFTVTVPKDL YVVEYGSNMT IECKFPVEKQ LDLAALIVYW EMEDKNIIQF VHGEEDLKTQ HSSYRQRARL LKDQLSLGNA ALQITDVKLQ DAGVYRCMIS YGGADYKRIT VKVNAPYAAA LHEHHHH // ID 6NNVC STANDARD; PRT; 127 AA. DT CONVERTED FROM PDB (SEQRES) 6NNV DE Programmed cell death 1 ligand 1 OS Homo sapiens CC EXPDTA X-RAY DIFFRACTION CC RESOLU 1.920 CC R-Factor 0.218 FT #SUB 69 86 ARG C 106 123 TYR B Protein S 1 FT #SUB 73 90 ASP C 96 113 ARG B Protein S 1 FT #SUB 73 90 ASP C 108 125 ARG B Protein S 9 FT #SUB 3 20 THR C 58 75 LYS D Protein S 1 FT #SUB 7 24 PRO C 65 82 ARG D Protein B 1 FT #SUB 20 37 THR C 9 9 TYR I Protein S 2 FT #SUB 22 39 GLU C 9 9 TYR I Protein S 8 FT #SUB 69 86 ARG C 11 11 TRP I Protein S 1 FT #SUB 71 88 LEU C 10 10 SAR I Protein S 5 FT #SUB 73 90 ASP C 13 13 LEU I Protein B 1 FT #SUB 74 91 GLN C 10 10 SAR I Protein S 3 FT #SUB 74 91 GLN C 12 12 TYR I Protein S 2 FT #SUB 77 94 LEU C 13 13 LEU I Protein S 1 FT #SUB 77 94 LEU C 15 15 LYS I Protein S 3 FT #SUB 83 100 GLN C 9 9 TYR I Protein S 1 FT #SUB 83 100 GLN C 11 11 TRP I Protein S 5 FT #SUB 37 54 ILE C 4 4 9KK K Protein S 1 FT #SUB 37 54 ILE C 7 7 VAL K Protein S 1 FT #SUB 37 54 ILE C 8 8 MEA K Protein A 3 FT #SUB 39 56 TYR C 2 2 PHE K Protein S 16 FT #SUB 39 56 TYR C 8 8 MEA K Protein S 1 FT #SUB 39 56 TYR C 12 12 TYR K Protein S 1 FT #SUB 39 56 TYR C 14 14 CYS K Protein S 1 FT #SUB 41 58 GLU C 12 12 TYR K Protein S 5 FT #SUB 41 58 GLU C 13 13 LEU K Protein S 6 FT #SUB 41 58 GLU C 14 14 CYS K Protein S 5 FT #SUB 43 60 GLU C 13 13 LEU K Protein B 2 FT #SUB 44 61 ASP C 13 13 LEU K Protein S 2 FT #SUB 44 61 ASP C 14 14 CYS K Protein B 3 FT #SUB 46 63 ASN C 1 1 ACE K Protein S 1 FT #SUB 49 66 GLN C 2 2 PHE K Protein S 1 FT #SUB 49 66 GLN C 3 3 MEA K Protein S 1 FT #SUB 51 68 VAL C 4 4 9KK K Protein S 1 FT #SUB 52 69 HIS C 4 4 9KK K Protein S 1 FT #SUB 59 76 THR C 1 1 ACE K Protein S 1 FT #SUB 96 113 ARG C 11 11 TRP K Protein S 2 FT #SUB 96 113 ARG C 13 13 LEU K Protein S 1 FT #SUB 98 115 MET C 8 8 MEA K Protein A 15 FT #SUB 98 115 MET C 11 11 TRP K Protein S 2 FT #SUB 98 115 MET C 12 12 TYR K Protein S 2 FT #SUB 99 116 ILE C 8 8 MEA K Protein B 7 FT #SUB 100 117 SER C 8 8 MEA K Protein A 4 FT #SUB 104 121 ALA C 11 11 TRP K Protein A 3 FT #SUB 105 122 ASP C 11 11 TRP K Protein B 7 FT #SUB 106 123 TYR C 11 11 TRP K Protein S 21 FT DISORDER 29 30 FT DISORDER 126 127 CC SEQUENCE 123 AA (ATOM); CC AFTVTVPKDL YVVEYGSNMT IECKFPVELD LAALIVYWEM EDKNIIQFVH GEEDLKTQHS CC SYRQRARLLK DQLSLGNAAL QITDVKLQDA GVYRCMISYG GADYKRITVK VNAPYAAALH CC EHH CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES AFTVTVPKDLYVVEYGSNMTIECKFPVEKQLDLAALIVYWEMEDKNIIQF CC ATOM AFTVTVPKDLYVVEYGSNMTIECKFPVE--LDLAALIVYWEMEDKNIIQF CC **************************** ******************** CC SEQRES VHGEEDLKTQHSSYRQRARLLKDQLSLGNAALQITDVKLQDAGVYRCMIS CC ATOM VHGEEDLKTQHSSYRQRARLLKDQLSLGNAALQITDVKLQDAGVYRCMIS CC ************************************************** CC SEQRES YGGADYKRITVKVNAPYAAALHEHHHH CC ATOM YGGADYKRITVKVNAPYAAALHEHH-- CC ************************* SQ SEQUENCE 127 AA; MW; CN; AFTVTVPKDL YVVEYGSNMT IECKFPVEKQ LDLAALIVYW EMEDKNIIQF VHGEEDLKTQ HSSYRQRARL LKDQLSLGNA ALQITDVKLQ DAGVYRCMIS YGGADYKRIT VKVNAPYAAA LHEHHHH // ID 6NNVD STANDARD; PRT; 127 AA. DT CONVERTED FROM PDB (SEQRES) 6NNV DE Programmed cell death 1 ligand 1 OS Homo sapiens CC EXPDTA X-RAY DIFFRACTION CC RESOLU 1.920 CC R-Factor 0.218 FT #SUB 69 86 ARG D 106 123 TYR A Protein S 1 FT #SUB 73 90 ASP D 96 113 ARG A Protein S 1 FT #SUB 73 90 ASP D 108 125 ARG A Protein S 4 FT #SUB 58 75 LYS D 3 20 THR C Protein S 1 FT #SUB 65 82 ARG D 7 24 PRO C Protein S 1 FT #SUB 20 37 THR D 9 9 TYR J Protein S 3 FT #SUB 22 39 GLU D 9 9 TYR J Protein S 9 FT #SUB 71 88 LEU D 10 10 SAR J Protein S 5 FT #SUB 73 90 ASP D 13 13 LEU J Protein B 1 FT #SUB 74 91 GLN D 10 10 SAR J Protein S 5 FT #SUB 74 91 GLN D 12 12 TYR J Protein S 1 FT #SUB 77 94 LEU D 13 13 LEU J Protein S 1 FT #SUB 77 94 LEU D 15 15 LYS J Protein S 2 FT #SUB 83 100 GLN D 9 9 TYR J Protein S 1 FT #SUB 83 100 GLN D 11 11 TRP J Protein S 5 FT #SUB 37 54 ILE D 8 8 MEA L Protein A 2 FT #SUB 39 56 TYR D 2 2 PHE L Protein S 16 FT #SUB 39 56 TYR D 8 8 MEA L Protein S 1 FT #SUB 39 56 TYR D 12 12 TYR L Protein S 1 FT #SUB 39 56 TYR D 14 14 CYS L Protein S 1 FT #SUB 41 58 GLU D 12 12 TYR L Protein S 5 FT #SUB 41 58 GLU D 13 13 LEU L Protein S 6 FT #SUB 41 58 GLU D 14 14 CYS L Protein S 5 FT #SUB 43 60 GLU D 13 13 LEU L Protein B 2 FT #SUB 44 61 ASP D 13 13 LEU L Protein A 2 FT #SUB 44 61 ASP D 14 14 CYS L Protein B 3 FT #SUB 46 63 ASN D 1 1 ACE L Protein S 4 FT #SUB 49 66 GLN D 2 2 PHE L Protein S 5 FT #SUB 49 66 GLN D 3 3 MEA L Protein S 2 FT #SUB 51 68 VAL D 4 4 9KK L Protein S 2 FT #SUB 59 76 THR D 1 1 ACE L Protein S 3 FT #SUB 59 76 THR D 3 3 MEA L Protein S 2 FT #SUB 96 113 ARG D 11 11 TRP L Protein S 2 FT #SUB 96 113 ARG D 13 13 LEU L Protein S 2 FT #SUB 98 115 MET D 8 8 MEA L Protein A 13 FT #SUB 98 115 MET D 11 11 TRP L Protein S 2 FT #SUB 98 115 MET D 12 12 TYR L Protein S 3 FT #SUB 99 116 ILE D 8 8 MEA L Protein B 6 FT #SUB 100 117 SER D 8 8 MEA L Protein A 4 FT #SUB 104 121 ALA D 11 11 TRP L Protein A 3 FT #SUB 105 122 ASP D 11 11 TRP L Protein B 7 FT #SUB 106 123 TYR D 11 11 TRP L Protein S 11 FT DISORDER 28 29 FT DISORDER 124 127 CC SEQUENCE 121 AA (ATOM); CC AFTVTVPKDL YVVEYGSNMT IECKFPVELD LAALIVYWEM EDKNIIQFVH GEEDLKTQHS CC SYRQRARLLK DQLSLGNAAL QITDVKLQDA GVYRCMISYG GADYKRITVK VNAPYAAALH CC E CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES AFTVTVPKDLYVVEYGSNMTIECKFPVEKQLDLAALIVYWEMEDKNIIQF CC ATOM AFTVTVPKDLYVVEYGSNMTIECKFPV--ELDLAALIVYWEMEDKNIIQF CC *************************** .******************** CC SEQRES VHGEEDLKTQHSSYRQRARLLKDQLSLGNAALQITDVKLQDAGVYRCMIS CC ATOM VHGEEDLKTQHSSYRQRARLLKDQLSLGNAALQITDVKLQDAGVYRCMIS CC ************************************************** CC SEQRES YGGADYKRITVKVNAPYAAALHEHHHH CC ATOM YGGADYKRITVKVNAPYAAALHE---- CC *********************** SQ SEQUENCE 127 AA; MW; CN; AFTVTVPKDL YVVEYGSNMT IECKFPVEKQ LDLAALIVYW EMEDKNIIQF VHGEEDLKTQ HSSYRQRARL LKDQLSLGNA ALQITDVKLQ DAGVYRCMIS YGGADYKRIT VKVNAPYAAA LHEHHHH // ID 6NNVI STANDARD; PRT; 16 AA. DT CONVERTED FROM PDB (SEQRES) 6NNV DE macrocyclic peptide OS syntetic CC EXPDTA X-RAY DIFFRACTION CC RESOLU 1.920 CC R-Factor 0.218 FT #SUB 3 3 MEA I 5 22 THR A Protein S 2 FT #SUB 1 1 ACE I 46 63 ASN B Protein B 4 FT #SUB 1 1 ACE I 59 76 THR B Protein B 1 FT #SUB 2 2 PHE I 39 56 TYR B Protein S 12 FT #SUB 2 2 PHE I 49 66 GLN B Protein S 5 FT #SUB 3 3 MEA I 49 66 GLN B Protein S 1 FT #SUB 4 4 9KK I 49 66 GLN B Protein S 2 FT #SUB 4 4 9KK I 51 68 VAL B Protein S 1 FT #SUB 8 8 MEA I 37 54 ILE B Protein S 1 FT #SUB 8 8 MEA I 39 56 TYR B Protein S 1 FT #SUB 8 8 MEA I 98 115 MET B Protein S 11 FT #SUB 8 8 MEA I 99 116 ILE B Protein S 3 FT #SUB 8 8 MEA I 100 117 SER B Protein S 4 FT #SUB 11 11 TRP I 96 113 ARG B Protein B 2 FT #SUB 11 11 TRP I 98 115 MET B Protein A 3 FT #SUB 11 11 TRP I 104 121 ALA B Protein S 3 FT #SUB 11 11 TRP I 105 122 ASP B Protein S 7 FT #SUB 11 11 TRP I 106 123 TYR B Protein S 12 FT #SUB 12 12 TYR I 39 56 TYR B Protein S 1 FT #SUB 12 12 TYR I 41 58 GLU B Protein A 5 FT #SUB 12 12 TYR I 98 115 MET B Protein A 3 FT #SUB 13 13 LEU I 41 58 GLU B Protein A 7 FT #SUB 13 13 LEU I 43 60 GLU B Protein S 2 FT #SUB 13 13 LEU I 44 61 ASP B Protein B 1 FT #SUB 13 13 LEU I 96 113 ARG B Protein S 2 FT #SUB 14 14 CYS I 39 56 TYR B Protein S 1 FT #SUB 14 14 CYS I 41 58 GLU B Protein A 4 FT #SUB 14 14 CYS I 44 61 ASP B Protein A 3 FT #SUB 9 9 TYR I 20 37 THR C Protein S 2 FT #SUB 9 9 TYR I 22 39 GLU C Protein S 8 FT #SUB 9 9 TYR I 83 100 GLN C Protein B 1 FT #SUB 10 10 SAR I 71 88 LEU C Protein B 5 FT #SUB 10 10 SAR I 74 91 GLN C Protein B 3 FT #SUB 11 11 TRP I 69 86 ARG C Protein S 1 FT #SUB 11 11 TRP I 83 100 GLN C Protein S 5 FT #SUB 12 12 TYR I 74 91 GLN C Protein B 2 FT #SUB 13 13 LEU I 73 90 ASP C Protein S 1 FT #SUB 13 13 LEU I 77 94 LEU C Protein S 1 FT #SUB 15 15 LYS I 77 94 LEU C Protein S 3 CC SEQUENCE 16 AA (ATOM); CC XFXXXDVXYX WYLCKX CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES XFXXXDVXYXWYLCKX CC ATOM XFXXXDVXYXWYLCKX CC **************** SQ SEQUENCE 16 AA; MW; CN; XFXXXDVXYX WYLCKX // ID 6NNVJ STANDARD; PRT; 16 AA. DT CONVERTED FROM PDB (SEQRES) 6NNV DE macrocyclic peptide OS syntetic CC EXPDTA X-RAY DIFFRACTION CC RESOLU 1.920 CC R-Factor 0.218 FT #SUB 1 1 ACE J 46 63 ASN A Protein B 4 FT #SUB 2 2 PHE J 39 56 TYR A Protein S 13 FT #SUB 2 2 PHE J 49 66 GLN A Protein S 6 FT #SUB 3 3 MEA J 49 66 GLN A Protein S 1 FT #SUB 4 4 9KK J 37 54 ILE A Protein S 1 FT #SUB 4 4 9KK J 51 68 VAL A Protein S 2 FT #SUB 7 7 VAL J 37 54 ILE A Protein S 2 FT #SUB 8 8 MEA J 37 54 ILE A Protein S 2 FT #SUB 8 8 MEA J 39 56 TYR A Protein S 1 FT #SUB 8 8 MEA J 98 115 MET A Protein S 14 FT #SUB 8 8 MEA J 99 116 ILE A Protein S 7 FT #SUB 8 8 MEA J 100 117 SER A Protein S 3 FT #SUB 11 11 TRP J 96 113 ARG A Protein B 2 FT #SUB 11 11 TRP J 98 115 MET A Protein S 1 FT #SUB 11 11 TRP J 104 121 ALA A Protein S 3 FT #SUB 11 11 TRP J 105 122 ASP A Protein S 8 FT #SUB 11 11 TRP J 106 123 TYR A Protein S 18 FT #SUB 12 12 TYR J 39 56 TYR A Protein S 1 FT #SUB 12 12 TYR J 41 58 GLU A Protein A 5 FT #SUB 12 12 TYR J 98 115 MET A Protein S 3 FT #SUB 13 13 LEU J 41 58 GLU A Protein A 7 FT #SUB 13 13 LEU J 43 60 GLU A Protein S 2 FT #SUB 13 13 LEU J 44 61 ASP A Protein B 2 FT #SUB 14 14 CYS J 39 56 TYR A Protein S 1 FT #SUB 14 14 CYS J 41 58 GLU A Protein A 4 FT #SUB 14 14 CYS J 44 61 ASP A Protein S 1 FT #SUB 9 9 TYR J 20 37 THR D Protein S 3 FT #SUB 9 9 TYR J 22 39 GLU D Protein S 9 FT #SUB 9 9 TYR J 83 100 GLN D Protein B 1 FT #SUB 10 10 SAR J 71 88 LEU D Protein B 5 FT #SUB 10 10 SAR J 74 91 GLN D Protein B 5 FT #SUB 11 11 TRP J 83 100 GLN D Protein S 5 FT #SUB 12 12 TYR J 74 91 GLN D Protein B 1 FT #SUB 13 13 LEU J 73 90 ASP D Protein S 1 FT #SUB 13 13 LEU J 77 94 LEU D Protein S 1 FT #SUB 15 15 LYS J 77 94 LEU D Protein S 2 CC SEQUENCE 16 AA (ATOM); CC XFXXXDVXYX WYLCKX CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES XFXXXDVXYXWYLCKX CC ATOM XFXXXDVXYXWYLCKX CC **************** SQ SEQUENCE 16 AA; MW; CN; XFXXXDVXYX WYLCKX // ID 6NNVK STANDARD; PRT; 16 AA. DT CONVERTED FROM PDB (SEQRES) 6NNV DE macrocyclic peptide OS syntetic CC EXPDTA X-RAY DIFFRACTION CC RESOLU 1.920 CC R-Factor 0.218 FT #SUB 1 1 ACE K 46 63 ASN C Protein B 1 FT #SUB 1 1 ACE K 59 76 THR C Protein B 1 FT #SUB 2 2 PHE K 39 56 TYR C Protein S 16 FT #SUB 2 2 PHE K 49 66 GLN C Protein S 1 FT #SUB 3 3 MEA K 49 66 GLN C Protein S 1 FT #SUB 4 4 9KK K 37 54 ILE C Protein S 1 FT #SUB 4 4 9KK K 51 68 VAL C Protein S 1 FT #SUB 4 4 9KK K 52 69 HIS C Protein S 1 FT #SUB 7 7 VAL K 37 54 ILE C Protein S 1 FT #SUB 8 8 MEA K 37 54 ILE C Protein S 3 FT #SUB 8 8 MEA K 39 56 TYR C Protein S 1 FT #SUB 8 8 MEA K 98 115 MET C Protein A 15 FT #SUB 8 8 MEA K 99 116 ILE C Protein S 7 FT #SUB 8 8 MEA K 100 117 SER C Protein S 4 FT #SUB 11 11 TRP K 96 113 ARG C Protein B 2 FT #SUB 11 11 TRP K 98 115 MET C Protein S 2 FT #SUB 11 11 TRP K 104 121 ALA C Protein S 3 FT #SUB 11 11 TRP K 105 122 ASP C Protein S 7 FT #SUB 11 11 TRP K 106 123 TYR C Protein S 21 FT #SUB 12 12 TYR K 39 56 TYR C Protein S 1 FT #SUB 12 12 TYR K 41 58 GLU C Protein A 5 FT #SUB 12 12 TYR K 98 115 MET C Protein S 2 FT #SUB 13 13 LEU K 41 58 GLU C Protein A 6 FT #SUB 13 13 LEU K 43 60 GLU C Protein S 2 FT #SUB 13 13 LEU K 44 61 ASP C Protein B 2 FT #SUB 13 13 LEU K 96 113 ARG C Protein S 1 FT #SUB 14 14 CYS K 39 56 TYR C Protein S 1 FT #SUB 14 14 CYS K 41 58 GLU C Protein A 5 FT #SUB 14 14 CYS K 44 61 ASP C Protein A 3 CC SEQUENCE 16 AA (ATOM); CC XFXXXDVXYX WYLCKX CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES XFXXXDVXYXWYLCKX CC ATOM XFXXXDVXYXWYLCKX CC **************** SQ SEQUENCE 16 AA; MW; CN; XFXXXDVXYX WYLCKX // ID 6NNVL STANDARD; PRT; 16 AA. DT CONVERTED FROM PDB (SEQRES) 6NNV DE macrocyclic peptide OS syntetic CC EXPDTA X-RAY DIFFRACTION CC RESOLU 1.920 CC R-Factor 0.218 FT #SUB 1 1 ACE L 46 63 ASN D Protein B 4 FT #SUB 1 1 ACE L 59 76 THR D Protein B 3 FT #SUB 2 2 PHE L 39 56 TYR D Protein S 16 FT #SUB 2 2 PHE L 49 66 GLN D Protein S 5 FT #SUB 3 3 MEA L 49 66 GLN D Protein S 2 FT #SUB 3 3 MEA L 59 76 THR D Protein S 2 FT #SUB 4 4 9KK L 51 68 VAL D Protein S 2 FT #SUB 8 8 MEA L 37 54 ILE D Protein S 2 FT #SUB 8 8 MEA L 39 56 TYR D Protein S 1 FT #SUB 8 8 MEA L 98 115 MET D Protein A 13 FT #SUB 8 8 MEA L 99 116 ILE D Protein S 6 FT #SUB 8 8 MEA L 100 117 SER D Protein S 4 FT #SUB 11 11 TRP L 96 113 ARG D Protein B 2 FT #SUB 11 11 TRP L 98 115 MET D Protein A 2 FT #SUB 11 11 TRP L 104 121 ALA D Protein S 3 FT #SUB 11 11 TRP L 105 122 ASP D Protein S 7 FT #SUB 11 11 TRP L 106 123 TYR D Protein S 11 FT #SUB 12 12 TYR L 39 56 TYR D Protein S 1 FT #SUB 12 12 TYR L 41 58 GLU D Protein A 5 FT #SUB 12 12 TYR L 98 115 MET D Protein A 3 FT #SUB 13 13 LEU L 41 58 GLU D Protein A 6 FT #SUB 13 13 LEU L 43 60 GLU D Protein S 2 FT #SUB 13 13 LEU L 44 61 ASP D Protein S 2 FT #SUB 13 13 LEU L 96 113 ARG D Protein S 2 FT #SUB 14 14 CYS L 39 56 TYR D Protein S 1 FT #SUB 14 14 CYS L 41 58 GLU D Protein A 5 FT #SUB 14 14 CYS L 44 61 ASP D Protein A 3 CC SEQUENCE 16 AA (ATOM); CC XFXXXDVXYX WYLCKX CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES XFXXXDVXYXWYLCKX CC ATOM XFXXXDVXYXWYLCKX CC **************** SQ SEQUENCE 16 AA; MW; CN; XFXXXDVXYX WYLCKX //