ID 3MHEA STANDARD; PRT; 125 AA. DT CONVERTED FROM PDB (SEQRES) 3MHE DE Steroid Delta-Isomerase OS Comamonas testosteroni CC EXPDTA X-RAY DIFFRACTION CC RESOLU 1.720 CC R-Factor 0.189 FT #SUB 68 68 THR A 69 69 GLN B Protein A 5 FT #SUB 69 69 GLN A 68 68 THR B Protein S 5 FT #SUB 69 69 GLN A 69 69 GLN B Protein S 5 FT #SUB 69 69 GLN A 81 81 ALA B Protein S 1 FT #SUB 70 70 GLU A 96 96 ALA B Protein S 1 FT #SUB 70 70 GLU A 119 119 LYS B Protein S 1 FT #SUB 70 70 GLU A 120 120 ASN B Protein S 6 FT #SUB 70 70 GLU A 122 122 HIS B Protein S 5 FT #SUB 71 71 VAL A 120 120 ASN B Protein B 4 FT #SUB 72 72 ARG A 96 96 ALA B Protein S 8 FT #SUB 72 72 ARG A 97 97 PRO B Protein S 5 FT #SUB 72 72 ARG A 98 98 ILE B Protein S 5 FT #SUB 72 72 ARG A 115 115 LEU B Protein A 5 FT #SUB 72 72 ARG A 120 120 ASN B Protein A 6 FT #SUB 73 73 ALA A 117 117 GLY B Protein B 1 FT #SUB 73 73 ALA A 120 120 ASN B Protein B 1 FT #SUB 74 74 VAL A 40 40 VAL B Protein S 2 FT #SUB 74 74 VAL A 115 115 LEU B Protein S 1 FT #SUB 74 74 VAL A 116 116 PHE B Protein S 4 FT #SUB 75 75 ALA A 40 40 VAL B Protein S 1 FT #SUB 77 77 GLU A 40 40 VAL B Protein S 4 FT #SUB 77 77 GLU A 113 113 ARG B Protein S 7 FT #SUB 77 77 GLU A 115 115 LEU B Protein S 2 FT #SUB 79 79 ALA A 98 98 ILE B Protein A 3 FT #SUB 79 79 ALA A 115 115 LEU B Protein S 1 FT #SUB 80 80 PHE A 98 98 ILE B Protein B 2 FT #SUB 81 81 ALA A 69 69 GLN B Protein S 2 FT #SUB 81 81 ALA A 72 72 ARG B Protein S 1 FT #SUB 96 96 ALA A 70 70 GLU B Protein S 3 FT #SUB 96 96 ALA A 72 72 ARG B Protein A 8 FT #SUB 97 97 PRO A 72 72 ARG B Protein B 5 FT #SUB 98 98 ILE A 72 72 ARG B Protein A 8 FT #SUB 98 98 ILE A 79 79 ALA B Protein S 3 FT #SUB 98 98 ILE A 80 80 PHE B Protein S 1 FT #SUB 98 98 ILE A 98 98 ILE B Protein S 1 FT #SUB 100 100 HIS A 113 113 ARG B Protein S 1 FT #SUB 100 100 HIS A 115 115 LEU B Protein S 2 FT #SUB 102 102 ARG A 113 113 ARG B Protein S 1 FT #SUB 113 113 ARG A 77 77 GLU B Protein S 5 FT #SUB 115 115 LEU A 72 72 ARG B Protein A 4 FT #SUB 115 115 LEU A 74 74 VAL B Protein S 2 FT #SUB 115 115 LEU A 77 77 GLU B Protein S 4 FT #SUB 115 115 LEU A 78 78 ALA B Protein S 1 FT #SUB 115 115 LEU A 79 79 ALA B Protein S 2 FT #SUB 116 116 PHE A 74 74 VAL B Protein B 4 FT #SUB 117 117 GLY A 73 73 ALA B Protein B 2 FT #SUB 117 117 GLY A 74 74 VAL B Protein B 1 FT #SUB 119 119 LYS A 70 70 GLU B Protein B 1 FT #SUB 120 120 ASN A 70 70 GLU B Protein A 6 FT #SUB 120 120 ASN A 71 71 VAL B Protein S 4 FT #SUB 120 120 ASN A 72 72 ARG B Protein S 8 FT #SUB 120 120 ASN A 73 73 ALA B Protein S 1 FT #SUB 122 122 HIS A 70 70 GLU B Protein S 7 FT #HET 6 6 HIS A 1 126 SO4 A A 7 FT #HET 9 9 ALA A 1 126 SO4 A S 1 FT #HET 13 13 ARG A 1 126 SO4 A S 3 FT #HET 56 56 ALA A 4 129 POL A B 3 FT #HET 100 100 HIS A 3 128 SO4 A S 5 FT #HET 102 102 ARG A 3 128 SO4 A S 6 FT #HET 102 102 ARG A 8 129 SO4 B S 1 FT #HET 104 104 ASN A 2 127 SO4 A A 4 FT #HET 105 105 GLY A 2 127 SO4 A B 4 FT DISORDER 39 42 FT DISORDER 125 125 CC SEQUENCE 120 AA (ATOM); CC MNTPEHMTAV VQRYVAALNA GDLDGIVALF ADDATVEDEP RSGTAAIREF YANSLKLPLA CC VELTQEVRAV ANEAAFAFTV SFEYQGRKTV VAPIDHFRFN GAGKVVSMRA LFGEKNIHAG CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES MNTPEHMTAVVQRYVAALNAGDLDGIVALFADDATVEDAVGSEPRSGTAA CC ATOM MNTPEHMTAVVQRYVAALNAGDLDGIVALFADDATVED----EPRSGTAA CC ************************************** ******** CC SEQRES IREFYANSLKLPLAVELTQEVRAVANEAAFAFTVSFEYQGRKTVVAPIDH CC ATOM IREFYANSLKLPLAVELTQEVRAVANEAAFAFTVSFEYQGRKTVVAPIDH CC ************************************************** CC SEQRES FRFNGAGKVVSMRALFGEKNIHAGA CC ATOM FRFNGAGKVVSMRALFGEKNIHAG- CC ************************ SQ SEQUENCE 125 AA; MW; CN; MNTPEHMTAV VQRYVAALNA GDLDGIVALF ADDATVEDAV GSEPRSGTAA IREFYANSLK LPLAVELTQE VRAVANEAAF AFTVSFEYQG RKTVVAPIDH FRFNGAGKVV SMRALFGEKN IHAGA // ID 3MHEB STANDARD; PRT; 125 AA. DT CONVERTED FROM PDB (SEQRES) 3MHE DE Steroid Delta-Isomerase OS Comamonas testosteroni CC EXPDTA X-RAY DIFFRACTION CC RESOLU 1.720 CC R-Factor 0.189 FT #SUB 40 40 VAL B 74 74 VAL A Protein S 2 FT #SUB 40 40 VAL B 75 75 ALA A Protein S 1 FT #SUB 40 40 VAL B 77 77 GLU A Protein S 4 FT #SUB 68 68 THR B 69 69 GLN A Protein A 5 FT #SUB 69 69 GLN B 68 68 THR A Protein S 5 FT #SUB 69 69 GLN B 69 69 GLN A Protein S 5 FT #SUB 69 69 GLN B 81 81 ALA A Protein S 2 FT #SUB 70 70 GLU B 96 96 ALA A Protein S 3 FT #SUB 70 70 GLU B 119 119 LYS A Protein S 1 FT #SUB 70 70 GLU B 120 120 ASN A Protein S 6 FT #SUB 70 70 GLU B 122 122 HIS A Protein S 7 FT #SUB 71 71 VAL B 120 120 ASN A Protein B 4 FT #SUB 72 72 ARG B 81 81 ALA A Protein S 1 FT #SUB 72 72 ARG B 96 96 ALA A Protein S 8 FT #SUB 72 72 ARG B 97 97 PRO A Protein S 5 FT #SUB 72 72 ARG B 98 98 ILE A Protein S 8 FT #SUB 72 72 ARG B 115 115 LEU A Protein A 4 FT #SUB 72 72 ARG B 120 120 ASN A Protein A 8 FT #SUB 73 73 ALA B 117 117 GLY A Protein B 2 FT #SUB 73 73 ALA B 120 120 ASN A Protein B 1 FT #SUB 74 74 VAL B 115 115 LEU A Protein S 2 FT #SUB 74 74 VAL B 116 116 PHE A Protein S 4 FT #SUB 74 74 VAL B 117 117 GLY A Protein S 1 FT #SUB 77 77 GLU B 113 113 ARG A Protein S 5 FT #SUB 77 77 GLU B 115 115 LEU A Protein S 4 FT #SUB 78 78 ALA B 115 115 LEU A Protein B 1 FT #SUB 79 79 ALA B 98 98 ILE A Protein A 3 FT #SUB 79 79 ALA B 115 115 LEU A Protein A 2 FT #SUB 80 80 PHE B 98 98 ILE A Protein B 1 FT #SUB 81 81 ALA B 69 69 GLN A Protein S 1 FT #SUB 96 96 ALA B 70 70 GLU A Protein S 1 FT #SUB 96 96 ALA B 72 72 ARG A Protein A 8 FT #SUB 97 97 PRO B 72 72 ARG A Protein B 5 FT #SUB 98 98 ILE B 72 72 ARG A Protein S 5 FT #SUB 98 98 ILE B 79 79 ALA A Protein S 3 FT #SUB 98 98 ILE B 80 80 PHE A Protein S 2 FT #SUB 98 98 ILE B 98 98 ILE A Protein S 1 FT #SUB 113 113 ARG B 77 77 GLU A Protein S 7 FT #SUB 113 113 ARG B 100 100 HIS A Protein S 1 FT #SUB 113 113 ARG B 102 102 ARG A Protein S 1 FT #SUB 115 115 LEU B 72 72 ARG A Protein A 5 FT #SUB 115 115 LEU B 74 74 VAL A Protein S 1 FT #SUB 115 115 LEU B 77 77 GLU A Protein S 2 FT #SUB 115 115 LEU B 79 79 ALA A Protein S 1 FT #SUB 115 115 LEU B 100 100 HIS A Protein S 2 FT #SUB 116 116 PHE B 74 74 VAL A Protein B 4 FT #SUB 117 117 GLY B 73 73 ALA A Protein B 1 FT #SUB 119 119 LYS B 70 70 GLU A Protein B 1 FT #SUB 120 120 ASN B 70 70 GLU A Protein A 6 FT #SUB 120 120 ASN B 71 71 VAL A Protein S 4 FT #SUB 120 120 ASN B 72 72 ARG A Protein S 6 FT #SUB 120 120 ASN B 73 73 ALA A Protein S 1 FT #SUB 122 122 HIS B 70 70 GLU A Protein S 5 FT #HET 89 89 GLN B 6 127 SO4 B B 1 FT #HET 90 90 GLY B 6 127 SO4 B B 2 FT #HET 91 91 ARG B 6 127 SO4 B A 13 FT #HET 100 100 HIS B 8 129 SO4 B S 2 FT #HET 102 102 ARG B 3 128 SO4 A S 3 FT #HET 102 102 ARG B 8 129 SO4 B S 11 FT #HET 104 104 ASN B 5 126 SO4 B A 7 FT #HET 105 105 GLY B 5 126 SO4 B B 4 FT #HET 111 111 SER B 8 129 SO4 B S 2 FT #HET 113 113 ARG B 8 129 SO4 B S 2 FT #HET 122 122 HIS B 7 128 SO4 B A 12 FT #HET 123 123 ALA B 7 128 SO4 B A 8 FT #HET 124 124 GLY B 7 128 SO4 B B 1 CC SEQUENCE 125 AA (ATOM); CC MNTPEHMTAV VQRYVAALNA GDLDGIVALF ADDATVEDAV GSEPRSGTAA IREFYANSLK CC LPLAVELTQE VRAVANEAAF AFTVSFEYQG RKTVVAPIDH FRFNGAGKVV SMRALFGEKN CC IHAGA CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES MNTPEHMTAVVQRYVAALNAGDLDGIVALFADDATVEDAVGSEPRSGTAA CC ATOM MNTPEHMTAVVQRYVAALNAGDLDGIVALFADDATVEDAVGSEPRSGTAA CC ************************************************** CC SEQRES IREFYANSLKLPLAVELTQEVRAVANEAAFAFTVSFEYQGRKTVVAPIDH CC ATOM IREFYANSLKLPLAVELTQEVRAVANEAAFAFTVSFEYQGRKTVVAPIDH CC ************************************************** CC SEQRES FRFNGAGKVVSMRALFGEKNIHAGA CC ATOM FRFNGAGKVVSMRALFGEKNIHAGA CC ************************* SQ SEQUENCE 125 AA; MW; CN; MNTPEHMTAV VQRYVAALNA GDLDGIVALF ADDATVEDAV GSEPRSGTAA IREFYANSLK LPLAVELTQE VRAVANEAAF AFTVSFEYQG RKTVVAPIDH FRFNGAGKVV SMRALFGEKN IHAGA //