ID 1K1UA STANDARD; PRT; 99 AA. DT CONVERTED FROM PDB (SEQRES) 1K1U DE PROTEASE RETROPEPSIN OS Human immunodeficiency virus 1 CC EXPDTA X-RAY DIFFRACTION CC RESOLU 1.550 CC R-Factor 0.194 FT #SUB 1 1 PRO A 97 197 LEU B Protein B 1 FT #SUB 1 1 PRO A 98 198 ASN B Protein B 2 FT #SUB 1 1 PRO A 99 199 PHE B Protein A 11 FT #SUB 2 2 GLN A 96 196 THR B Protein S 8 FT #SUB 2 2 GLN A 97 197 LEU B Protein A 3 FT #SUB 2 2 GLN A 98 198 ASN B Protein A 7 FT #SUB 3 3 ILE A 96 196 THR B Protein B 4 FT #SUB 3 3 ILE A 97 197 LEU B Protein B 7 FT #SUB 3 3 ILE A 99 199 PHE B Protein S 1 FT #SUB 5 5 LEU A 26 126 THR B Protein S 1 FT #SUB 5 5 LEU A 87 187 ARG B Protein B 6 FT #SUB 5 5 LEU A 91 191 THR B Protein A 3 FT #SUB 5 5 LEU A 95 195 ALA B Protein S 2 FT #SUB 6 6 TRP A 87 187 ARG B Protein B 2 FT #SUB 6 6 TRP A 91 191 THR B Protein A 3 FT #SUB 7 7 LYS A 87 187 ARG B Protein B 6 FT #SUB 8 8 ARG A 29 129 ASP B Protein S 10 FT #SUB 8 8 ARG A 87 187 ARG B Protein A 8 FT #SUB 9 9 PRO A 26 126 THR B Protein S 2 FT #SUB 9 9 PRO A 87 187 ARG B Protein S 1 FT #SUB 23 23 LEU A 27 127 GLY B Protein S 1 FT #SUB 24 24 LEU A 26 126 THR B Protein B 4 FT #SUB 24 24 LEU A 97 197 LEU B Protein S 1 FT #SUB 25 25 ASP A 25 125 ASP B Protein S 3 FT #SUB 25 25 ASP A 26 126 THR B Protein B 3 FT #SUB 25 25 ASP A 27 127 GLY B Protein A 6 FT #SUB 26 26 THR A 5 105 LEU B Protein S 2 FT #SUB 26 26 THR A 9 109 PRO B Protein B 2 FT #SUB 26 26 THR A 24 124 LEU B Protein A 5 FT #SUB 26 26 THR A 25 125 ASP B Protein S 3 FT #SUB 26 26 THR A 26 126 THR B Protein A 11 FT #SUB 26 26 THR A 97 197 LEU B Protein S 1 FT #SUB 27 27 GLY A 23 123 LEU B Protein B 2 FT #SUB 27 27 GLY A 25 125 ASP B Protein B 5 FT #SUB 29 29 ASP A 8 108 ARG B Protein S 11 FT #SUB 48 48 GLY A 50 150 ILE B Protein B 1 FT #SUB 49 49 GLY A 50 150 ILE B Protein B 7 FT #SUB 49 49 GLY A 81 181 PRO B Protein B 1 FT #SUB 50 50 ILE A 48 148 GLY B Protein S 1 FT #SUB 50 50 ILE A 49 149 GLY B Protein S 1 FT #SUB 50 50 ILE A 50 150 ILE B Protein B 2 FT #SUB 50 50 ILE A 54 154 ILE B Protein A 2 FT #SUB 50 50 ILE A 80 180 THR B Protein S 1 FT #SUB 50 50 ILE A 81 181 PRO B Protein A 4 FT #SUB 50 50 ILE A 84 184 ILE B Protein S 1 FT #SUB 51 51 GLY A 50 150 ILE B Protein B 3 FT #SUB 51 51 GLY A 51 151 GLY B Protein B 7 FT #SUB 51 51 GLY A 52 152 GLY B Protein B 4 FT #SUB 51 51 GLY A 54 154 ILE B Protein B 1 FT #SUB 52 52 GLY A 50 150 ILE B Protein B 3 FT #SUB 52 52 GLY A 51 151 GLY B Protein B 5 FT #SUB 54 54 ILE A 51 151 GLY B Protein S 1 FT #SUB 67 67 ALA A 99 199 PHE B Protein S 1 FT #SUB 69 69 HIS A 99 199 PHE B Protein S 5 FT #SUB 80 80 THR A 50 150 ILE B Protein S 1 FT #SUB 84 84 ILE A 50 150 ILE B Protein S 1 FT #SUB 87 87 ARG A 5 105 LEU B Protein S 6 FT #SUB 87 87 ARG A 6 106 TRP B Protein S 2 FT #SUB 87 87 ARG A 7 107 LYS B Protein S 6 FT #SUB 87 87 ARG A 8 108 ARG B Protein S 9 FT #SUB 87 87 ARG A 9 109 PRO B Protein S 1 FT #SUB 90 90 MET A 5 105 LEU B Protein S 2 FT #SUB 90 90 MET A 97 197 LEU B Protein S 1 FT #SUB 91 91 THR A 5 105 LEU B Protein S 3 FT #SUB 91 91 THR A 6 106 TRP B Protein A 13 FT #SUB 93 93 ILE A 99 199 PHE B Protein B 1 FT #SUB 94 94 GLY A 98 198 ASN B Protein B 1 FT #SUB 94 94 GLY A 99 199 PHE B Protein B 2 FT #SUB 95 95 ALA A 5 105 LEU B Protein B 2 FT #SUB 95 95 ALA A 98 198 ASN B Protein A 3 FT #SUB 95 95 ALA A 99 199 PHE B Protein A 2 FT #SUB 96 96 THR A 2 102 GLN B Protein S 6 FT #SUB 96 96 THR A 3 103 ILE B Protein A 4 FT #SUB 96 96 THR A 4 104 THR B Protein S 1 FT #SUB 96 96 THR A 96 196 THR B Protein B 1 FT #SUB 96 96 THR A 97 197 LEU B Protein B 3 FT #SUB 96 96 THR A 98 198 ASN B Protein A 6 FT #SUB 97 97 LEU A 1 101 PRO B Protein B 1 FT #SUB 97 97 LEU A 2 102 GLN B Protein B 2 FT #SUB 97 97 LEU A 3 103 ILE B Protein B 7 FT #SUB 97 97 LEU A 26 126 THR B Protein S 1 FT #SUB 97 97 LEU A 96 196 THR B Protein A 3 FT #SUB 97 97 LEU A 97 197 LEU B Protein S 1 FT #SUB 98 98 ASN A 1 101 PRO B Protein B 2 FT #SUB 98 98 ASN A 2 102 GLN B Protein S 6 FT #SUB 98 98 ASN A 94 194 GLY B Protein B 1 FT #SUB 98 98 ASN A 95 195 ALA B Protein B 2 FT #SUB 98 98 ASN A 96 196 THR B Protein A 6 FT #SUB 98 98 ASN A 98 198 ASN B Protein S 5 FT #SUB 99 99 PHE A 1 101 PRO B Protein A 10 FT #SUB 99 99 PHE A 3 103 ILE B Protein S 1 FT #SUB 99 99 PHE A 24 124 LEU B Protein S 1 FT #SUB 99 99 PHE A 69 169 HIS B Protein A 5 FT #SUB 99 99 PHE A 93 193 ILE B Protein S 3 FT #SUB 99 99 PHE A 94 194 GLY B Protein A 3 FT #SUB 99 99 PHE A 95 195 ALA B Protein S 2 FT #HET 8 8 ARG A 1 301 0Q4 B S 2 FT #HET 23 23 LEU A 1 301 0Q4 B S 2 FT #HET 25 25 ASP A 1 301 0Q4 B S 7 FT #HET 27 27 GLY A 1 301 0Q4 B B 10 FT #HET 28 28 ALA A 1 301 0Q4 B A 8 FT #HET 29 29 ASP A 1 301 0Q4 B A 18 FT #HET 30 30 ASP A 1 301 0Q4 B A 21 FT #HET 45 45 ILE A 1 301 0Q4 B S 2 FT #HET 46 46 MET A 1 301 0Q4 B B 3 FT #HET 47 47 ILE A 1 301 0Q4 B A 7 FT #HET 48 48 GLY A 1 301 0Q4 B B 16 FT #HET 49 49 GLY A 1 301 0Q4 B B 4 FT #HET 50 50 ILE A 1 301 0Q4 B A 4 FT #HET 53 53 PHE A 1 301 0Q4 B S 1 FT #HET 58 58 GLN A 1 301 0Q4 B S 1 FT #HET 82 82 VAL A 1 301 0Q4 B S 4 FT #HET 84 84 ILE A 1 301 0Q4 B S 2 CC SEQUENCE 99 AA (ATOM); CC PQITLWKRPL VTIKIGGQLK EALLDTGADD TVIEEMSLPG RWKPIMIGGI GGFIKVRQYD CC QIIIEIAGHK AIGTVLVGPT PVNIIGRNLM TQIGATLNF CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES PQITLWKRPLVTIKIGGQLKEALLDTGADDTVIEEMSLPGRWKPIMIGGI CC ATOM PQITLWKRPLVTIKIGGQLKEALLDTGADDTVIEEMSLPGRWKPIMIGGI CC ************************************************** CC SEQRES GGFIKVRQYDQIIIEIAGHKAIGTVLVGPTPVNIIGRNLMTQIGATLNF CC ATOM GGFIKVRQYDQIIIEIAGHKAIGTVLVGPTPVNIIGRNLMTQIGATLNF CC ************************************************* SQ SEQUENCE 99 AA; MW; CN; PQITLWKRPL VTIKIGGQLK EALLDTGADD TVIEEMSLPG RWKPIMIGGI GGFIKVRQYD QIIIEIAGHK AIGTVLVGPT PVNIIGRNLM TQIGATLNF // ID 1K1UB STANDARD; PRT; 99 AA. DT CONVERTED FROM PDB (SEQRES) 1K1U DE PROTEASE RETROPEPSIN OS Human immunodeficiency virus 1 CC EXPDTA X-RAY DIFFRACTION CC RESOLU 1.550 CC R-Factor 0.194 FT #SUB 1 101 PRO B 97 97 LEU A Protein B 1 FT #SUB 1 101 PRO B 98 98 ASN A Protein B 2 FT #SUB 1 101 PRO B 99 99 PHE A Protein A 10 FT #SUB 2 102 GLN B 96 96 THR A Protein S 6 FT #SUB 2 102 GLN B 97 97 LEU A Protein B 2 FT #SUB 2 102 GLN B 98 98 ASN A Protein A 6 FT #SUB 3 103 ILE B 96 96 THR A Protein B 4 FT #SUB 3 103 ILE B 97 97 LEU A Protein A 7 FT #SUB 3 103 ILE B 99 99 PHE A Protein S 1 FT #SUB 4 104 THR B 96 96 THR A Protein S 1 FT #SUB 5 105 LEU B 26 26 THR A Protein S 2 FT #SUB 5 105 LEU B 87 87 ARG A Protein B 6 FT #SUB 5 105 LEU B 90 90 MET A Protein S 2 FT #SUB 5 105 LEU B 91 91 THR A Protein A 3 FT #SUB 5 105 LEU B 95 95 ALA A Protein S 2 FT #SUB 6 106 TRP B 87 87 ARG A Protein B 2 FT #SUB 6 106 TRP B 91 91 THR A Protein A 13 FT #SUB 7 107 LYS B 87 87 ARG A Protein B 6 FT #SUB 8 108 ARG B 29 29 ASP A Protein S 11 FT #SUB 8 108 ARG B 87 87 ARG A Protein A 9 FT #SUB 9 109 PRO B 26 26 THR A Protein S 2 FT #SUB 9 109 PRO B 87 87 ARG A Protein S 1 FT #SUB 23 123 LEU B 27 27 GLY A Protein S 2 FT #SUB 24 124 LEU B 26 26 THR A Protein B 5 FT #SUB 24 124 LEU B 99 99 PHE A Protein S 1 FT #SUB 25 125 ASP B 25 25 ASP A Protein S 3 FT #SUB 25 125 ASP B 26 26 THR A Protein B 3 FT #SUB 25 125 ASP B 27 27 GLY A Protein A 5 FT #SUB 26 126 THR B 5 5 LEU A Protein S 1 FT #SUB 26 126 THR B 9 9 PRO A Protein B 2 FT #SUB 26 126 THR B 24 24 LEU A Protein A 4 FT #SUB 26 126 THR B 25 25 ASP A Protein S 3 FT #SUB 26 126 THR B 26 26 THR A Protein A 11 FT #SUB 26 126 THR B 97 97 LEU A Protein S 1 FT #SUB 27 127 GLY B 23 23 LEU A Protein B 1 FT #SUB 27 127 GLY B 25 25 ASP A Protein B 6 FT #SUB 29 129 ASP B 8 8 ARG A Protein S 10 FT #SUB 48 148 GLY B 50 50 ILE A Protein B 1 FT #SUB 49 149 GLY B 50 50 ILE A Protein B 1 FT #SUB 50 150 ILE B 48 48 GLY A Protein S 1 FT #SUB 50 150 ILE B 49 49 GLY A Protein A 7 FT #SUB 50 150 ILE B 50 50 ILE A Protein B 2 FT #SUB 50 150 ILE B 51 51 GLY A Protein B 3 FT #SUB 50 150 ILE B 52 52 GLY A Protein A 3 FT #SUB 50 150 ILE B 80 80 THR A Protein S 1 FT #SUB 50 150 ILE B 84 84 ILE A Protein S 1 FT #SUB 51 151 GLY B 51 51 GLY A Protein B 7 FT #SUB 51 151 GLY B 52 52 GLY A Protein B 5 FT #SUB 51 151 GLY B 54 54 ILE A Protein B 1 FT #SUB 52 152 GLY B 51 51 GLY A Protein B 4 FT #SUB 54 154 ILE B 50 50 ILE A Protein S 2 FT #SUB 54 154 ILE B 51 51 GLY A Protein S 1 FT #SUB 69 169 HIS B 99 99 PHE A Protein S 5 FT #SUB 80 180 THR B 50 50 ILE A Protein S 1 FT #SUB 81 181 PRO B 49 49 GLY A Protein S 1 FT #SUB 81 181 PRO B 50 50 ILE A Protein S 4 FT #SUB 84 184 ILE B 50 50 ILE A Protein S 1 FT #SUB 87 187 ARG B 5 5 LEU A Protein S 6 FT #SUB 87 187 ARG B 6 6 TRP A Protein S 2 FT #SUB 87 187 ARG B 7 7 LYS A Protein S 6 FT #SUB 87 187 ARG B 8 8 ARG A Protein S 8 FT #SUB 87 187 ARG B 9 9 PRO A Protein S 1 FT #SUB 91 191 THR B 5 5 LEU A Protein S 3 FT #SUB 91 191 THR B 6 6 TRP A Protein S 3 FT #SUB 93 193 ILE B 99 99 PHE A Protein A 3 FT #SUB 94 194 GLY B 98 98 ASN A Protein B 1 FT #SUB 94 194 GLY B 99 99 PHE A Protein B 3 FT #SUB 95 195 ALA B 5 5 LEU A Protein B 2 FT #SUB 95 195 ALA B 98 98 ASN A Protein B 2 FT #SUB 95 195 ALA B 99 99 PHE A Protein B 2 FT #SUB 96 196 THR B 2 2 GLN A Protein S 8 FT #SUB 96 196 THR B 3 3 ILE A Protein A 4 FT #SUB 96 196 THR B 96 96 THR A Protein B 1 FT #SUB 96 196 THR B 97 97 LEU A Protein B 3 FT #SUB 96 196 THR B 98 98 ASN A Protein A 6 FT #SUB 97 197 LEU B 1 1 PRO A Protein B 1 FT #SUB 97 197 LEU B 2 2 GLN A Protein B 3 FT #SUB 97 197 LEU B 3 3 ILE A Protein A 7 FT #SUB 97 197 LEU B 24 24 LEU A Protein S 1 FT #SUB 97 197 LEU B 26 26 THR A Protein S 1 FT #SUB 97 197 LEU B 90 90 MET A Protein S 1 FT #SUB 97 197 LEU B 96 96 THR A Protein A 3 FT #SUB 97 197 LEU B 97 97 LEU A Protein S 1 FT #SUB 98 198 ASN B 1 1 PRO A Protein B 2 FT #SUB 98 198 ASN B 2 2 GLN A Protein S 7 FT #SUB 98 198 ASN B 94 94 GLY A Protein B 1 FT #SUB 98 198 ASN B 95 95 ALA A Protein B 3 FT #SUB 98 198 ASN B 96 96 THR A Protein A 6 FT #SUB 98 198 ASN B 98 98 ASN A Protein S 5 FT #SUB 99 199 PHE B 1 1 PRO A Protein A 11 FT #SUB 99 199 PHE B 3 3 ILE A Protein S 1 FT #SUB 99 199 PHE B 67 67 ALA A Protein S 1 FT #SUB 99 199 PHE B 69 69 HIS A Protein A 5 FT #SUB 99 199 PHE B 93 93 ILE A Protein S 1 FT #SUB 99 199 PHE B 94 94 GLY A Protein A 2 FT #SUB 99 199 PHE B 95 95 ALA A Protein S 2 FT #HET 8 108 ARG B 1 301 0Q4 B S 13 FT #HET 23 123 LEU B 1 301 0Q4 B S 2 FT #HET 25 125 ASP B 1 301 0Q4 B S 7 FT #HET 27 127 GLY B 1 301 0Q4 B B 11 FT #HET 28 128 ALA B 1 301 0Q4 B A 9 FT #HET 29 129 ASP B 1 301 0Q4 B A 21 FT #HET 30 130 ASP B 1 301 0Q4 B A 17 FT #HET 32 132 VAL B 1 301 0Q4 B S 1 FT #HET 45 145 ILE B 1 301 0Q4 B S 2 FT #HET 46 146 MET B 1 301 0Q4 B B 4 FT #HET 47 147 ILE B 1 301 0Q4 B A 10 FT #HET 48 148 GLY B 1 301 0Q4 B B 17 FT #HET 49 149 GLY B 1 301 0Q4 B B 5 FT #HET 50 150 ILE B 1 301 0Q4 B A 8 FT #HET 81 181 PRO B 1 301 0Q4 B S 4 FT #HET 82 182 VAL B 1 301 0Q4 B S 4 FT #HET 84 184 ILE B 1 301 0Q4 B S 4 CC SEQUENCE 99 AA (ATOM); CC PQITLWKRPL VTIKIGGQLK EALLDTGADD TVIEEMSLPG RWKPIMIGGI GGFIKVRQYD CC QIIIEIAGHK AIGTVLVGPT PVNIIGRNLM TQIGATLNF CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES PQITLWKRPLVTIKIGGQLKEALLDTGADDTVIEEMSLPGRWKPIMIGGI CC ATOM PQITLWKRPLVTIKIGGQLKEALLDTGADDTVIEEMSLPGRWKPIMIGGI CC ************************************************** CC SEQRES GGFIKVRQYDQIIIEIAGHKAIGTVLVGPTPVNIIGRNLMTQIGATLNF CC ATOM GGFIKVRQYDQIIIEIAGHKAIGTVLVGPTPVNIIGRNLMTQIGATLNF CC ************************************************* SQ SEQUENCE 99 AA; MW; CN; PQITLWKRPL VTIKIGGQLK EALLDTGADD TVIEEMSLPG RWKPIMIGGI GGFIKVRQYD QIIIEIAGHK AIGTVLVGPT PVNIIGRNLM TQIGATLNF //