ID 1GULA STANDARD; PRT; 222 AA. DT CONVERTED FROM PDB (SEQRES) 1GUL DE Glutathione S-transferase A4 OS Homo sapiens CC EXPDTA X-RAY DIFFRACTION CC RESOLU 2.700 CC R-Factor 0.250 FT #SUB 51 51 LEU A 135 135 VAL B Protein A 2 FT #SUB 52 52 PHE A 94 94 MET B Protein S 1 FT #SUB 52 52 PHE A 98 98 GLY B Protein S 2 FT #SUB 52 52 PHE A 131 131 ARG B Protein A 4 FT #SUB 52 52 PHE A 132 132 TYR B Protein S 5 FT #SUB 53 53 GLN A 131 131 ARG B Protein S 4 FT #SUB 54 54 GLN A 132 132 TYR B Protein S 1 FT #SUB 65 65 LEU A 94 94 MET B Protein A 4 FT #SUB 66 66 VAL A 94 94 MET B Protein A 7 FT #SUB 67 67 GLN A 97 97 GLU B Protein S 6 FT #SUB 67 67 GLN A 98 98 GLY B Protein S 4 FT #SUB 67 67 GLN A 101 101 ASP B Protein S 3 FT #SUB 69 69 ARG A 69 69 ARG B Protein S 4 FT #SUB 69 69 ARG A 97 97 GLU B Protein S 1 FT #SUB 70 70 SER A 93 93 ASP B Protein A 8 FT #SUB 70 70 SER A 94 94 MET B Protein S 3 FT #SUB 70 70 SER A 97 97 GLU B Protein S 2 FT #SUB 73 73 HIS A 73 73 HIS B Protein S 1 FT #SUB 73 73 HIS A 93 93 ASP B Protein S 6 FT #SUB 74 74 TYR A 87 87 LYS B Protein S 3 FT #SUB 74 74 TYR A 90 90 THR B Protein S 1 FT #SUB 78 78 LYS A 86 86 LEU B Protein S 1 FT #SUB 86 86 LEU A 74 74 TYR B Protein S 1 FT #SUB 86 86 LEU A 78 78 LYS B Protein S 1 FT #SUB 87 87 LYS A 63 63 MET B Protein S 1 FT #SUB 87 87 LYS A 74 74 TYR B Protein S 3 FT #SUB 89 89 ARG A 89 89 ARG B Protein S 4 FT #SUB 90 90 THR A 65 65 LEU B Protein S 1 FT #SUB 90 90 THR A 74 74 TYR B Protein S 1 FT #SUB 93 93 ASP A 70 70 SER B Protein A 11 FT #SUB 93 93 ASP A 73 73 HIS B Protein S 6 FT #SUB 94 94 MET A 52 52 PHE B Protein B 1 FT #SUB 94 94 MET A 65 65 LEU B Protein S 3 FT #SUB 94 94 MET A 66 66 VAL B Protein S 7 FT #SUB 94 94 MET A 70 70 SER B Protein A 3 FT #SUB 95 95 TYR A 51 51 LEU B Protein S 1 FT #SUB 97 97 GLU A 67 67 GLN B Protein A 6 FT #SUB 97 97 GLU A 69 69 ARG B Protein S 2 FT #SUB 97 97 GLU A 70 70 SER B Protein S 1 FT #SUB 98 98 GLY A 52 52 PHE B Protein B 1 FT #SUB 98 98 GLY A 67 67 GLN B Protein B 3 FT #SUB 101 101 ASP A 67 67 GLN B Protein S 2 FT #SUB 131 131 ARG A 52 52 PHE B Protein S 3 FT #SUB 131 131 ARG A 53 53 GLN B Protein S 3 FT #SUB 132 132 TYR A 52 52 PHE B Protein S 3 FT #SUB 135 135 VAL A 51 51 LEU B Protein S 2 FT #SUB 135 135 VAL A 52 52 PHE B Protein S 1 FT #HET 9 9 TYR A 1 301 IBG A S 1 FT #HET 15 15 ARG A 1 301 IBG A S 2 FT #HET 45 45 GLN A 1 301 IBG A S 1 FT #HET 53 53 GLN A 1 301 IBG A B 3 FT #HET 54 54 GLN A 1 301 IBG A A 14 FT #HET 55 55 VAL A 1 301 IBG A A 12 FT #HET 56 56 PRO A 1 301 IBG A S 1 FT #HET 67 67 GLN A 1 301 IBG A A 6 FT #HET 68 68 THR A 1 301 IBG A A 9 FT #HET 101 101 ASP A 2 301 IBG B S 4 FT #HET 107 107 ILE A 1 301 IBG A A 2 FT #HET 131 131 ARG A 2 301 IBG B S 3 FT #HET 212 212 TYR A 1 301 IBG A S 1 FT #HET 220 220 PHE A 1 301 IBG A S 6 FT DISORDER 1 3 FT DISORDER 221 222 CC SEQUENCE 217 AA (ATOM); CC RPKLHYPNGR GRMESVRWVL AAAGVEFDEE FLETKEQLYK LQDGNHLLFQ QVPMVEIDGM CC KLVQTRSILH YIADKHNLFG KNLKERTLID MYVEGTLDLL ELLIMHPFLK PDDQQKEVVN CC MAQKAIIRYF PVFEKILRGH GQSFLVGNQL SLADVILLQT ILALEEKIPN ILSAFPFLQE CC YTVKLSNIPT IKRFLEPGSK KKPPPDEIYV RTVYNIF CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES MAARPKLHYPNGRGRMESVRWVLAAAGVEFDEEFLETKEQLYKLQDGNHL CC ATOM ---RPKLHYPNGRGRMESVRWVLAAAGVEFDEEFLETKEQLYKLQDGNHL CC *********************************************** CC SEQRES LFQQVPMVEIDGMKLVQTRSILHYIADKHNLFGKNLKERTLIDMYVEGTL CC ATOM LFQQVPMVEIDGMKLVQTRSILHYIADKHNLFGKNLKERTLIDMYVEGTL CC ************************************************** CC SEQRES DLLELLIMHPFLKPDDQQKEVVNMAQKAIIRYFPVFEKILRGHGQSFLVG CC ATOM DLLELLIMHPFLKPDDQQKEVVNMAQKAIIRYFPVFEKILRGHGQSFLVG CC ************************************************** CC SEQRES NQLSLADVILLQTILALEEKIPNILSAFPFLQEYTVKLSNIPTIKRFLEP CC ATOM NQLSLADVILLQTILALEEKIPNILSAFPFLQEYTVKLSNIPTIKRFLEP CC ************************************************** CC SEQRES GSKKKPPPDEIYVRTVYNIFRP CC ATOM GSKKKPPPDEIYVRTVYNIF-- CC ******************** SQ SEQUENCE 222 AA; MW; CN; MAARPKLHYP NGRGRMESVR WVLAAAGVEF DEEFLETKEQ LYKLQDGNHL LFQQVPMVEI DGMKLVQTRS ILHYIADKHN LFGKNLKERT LIDMYVEGTL DLLELLIMHP FLKPDDQQKE VVNMAQKAII RYFPVFEKIL RGHGQSFLVG NQLSLADVIL LQTILALEEK IPNILSAFPF LQEYTVKLSN IPTIKRFLEP GSKKKPPPDE IYVRTVYNIF RP // ID 1GULB STANDARD; PRT; 222 AA. DT CONVERTED FROM PDB (SEQRES) 1GUL DE Glutathione S-transferase A4 OS Homo sapiens CC EXPDTA X-RAY DIFFRACTION CC RESOLU 2.700 CC R-Factor 0.250 FT #SUB 51 51 LEU B 95 95 TYR A Protein S 1 FT #SUB 51 51 LEU B 135 135 VAL A Protein A 2 FT #SUB 52 52 PHE B 94 94 MET A Protein S 1 FT #SUB 52 52 PHE B 98 98 GLY A Protein S 1 FT #SUB 52 52 PHE B 131 131 ARG A Protein B 3 FT #SUB 52 52 PHE B 132 132 TYR A Protein S 3 FT #SUB 52 52 PHE B 135 135 VAL A Protein S 1 FT #SUB 53 53 GLN B 131 131 ARG A Protein S 3 FT #SUB 63 63 MET B 87 87 LYS A Protein S 1 FT #SUB 65 65 LEU B 90 90 THR A Protein S 1 FT #SUB 65 65 LEU B 94 94 MET A Protein A 3 FT #SUB 66 66 VAL B 94 94 MET A Protein A 7 FT #SUB 67 67 GLN B 97 97 GLU A Protein S 6 FT #SUB 67 67 GLN B 98 98 GLY A Protein S 3 FT #SUB 67 67 GLN B 101 101 ASP A Protein S 2 FT #SUB 69 69 ARG B 69 69 ARG A Protein S 4 FT #SUB 69 69 ARG B 97 97 GLU A Protein S 2 FT #SUB 70 70 SER B 93 93 ASP A Protein A 11 FT #SUB 70 70 SER B 94 94 MET A Protein S 3 FT #SUB 70 70 SER B 97 97 GLU A Protein S 1 FT #SUB 73 73 HIS B 73 73 HIS A Protein S 1 FT #SUB 73 73 HIS B 93 93 ASP A Protein S 6 FT #SUB 74 74 TYR B 86 86 LEU A Protein S 1 FT #SUB 74 74 TYR B 87 87 LYS A Protein S 3 FT #SUB 74 74 TYR B 90 90 THR A Protein S 1 FT #SUB 78 78 LYS B 86 86 LEU A Protein S 1 FT #SUB 86 86 LEU B 78 78 LYS A Protein S 1 FT #SUB 87 87 LYS B 74 74 TYR A Protein S 3 FT #SUB 89 89 ARG B 89 89 ARG A Protein S 4 FT #SUB 90 90 THR B 74 74 TYR A Protein S 1 FT #SUB 93 93 ASP B 70 70 SER A Protein A 8 FT #SUB 93 93 ASP B 73 73 HIS A Protein S 6 FT #SUB 94 94 MET B 52 52 PHE A Protein B 1 FT #SUB 94 94 MET B 65 65 LEU A Protein S 4 FT #SUB 94 94 MET B 66 66 VAL A Protein S 7 FT #SUB 94 94 MET B 70 70 SER A Protein A 3 FT #SUB 97 97 GLU B 67 67 GLN A Protein A 6 FT #SUB 97 97 GLU B 69 69 ARG A Protein S 1 FT #SUB 97 97 GLU B 70 70 SER A Protein S 2 FT #SUB 98 98 GLY B 52 52 PHE A Protein B 2 FT #SUB 98 98 GLY B 67 67 GLN A Protein B 4 FT #SUB 101 101 ASP B 67 67 GLN A Protein S 3 FT #SUB 131 131 ARG B 52 52 PHE A Protein A 4 FT #SUB 131 131 ARG B 53 53 GLN A Protein S 4 FT #SUB 132 132 TYR B 52 52 PHE A Protein S 5 FT #SUB 132 132 TYR B 54 54 GLN A Protein S 1 FT #SUB 135 135 VAL B 51 51 LEU A Protein S 2 FT #SUB 200 200 PRO B 146 146 SER G Protein S 2 FT #SUB 200 200 PRO B 147 147 PHE G Protein S 1 FT #SUB 200 200 PRO B 191 191 ILE G Protein B 1 FT #SUB 201 201 GLY B 191 191 ILE G Protein B 2 FT #SUB 201 201 GLY B 192 192 PRO G Protein B 5 FT #HET 9 9 TYR B 2 301 IBG B S 1 FT #HET 15 15 ARG B 2 301 IBG B S 2 FT #HET 45 45 GLN B 2 301 IBG B S 1 FT #HET 53 53 GLN B 2 301 IBG B B 3 FT #HET 54 54 GLN B 2 301 IBG B A 14 FT #HET 55 55 VAL B 2 301 IBG B A 12 FT #HET 56 56 PRO B 2 301 IBG B S 1 FT #HET 67 67 GLN B 2 301 IBG B A 6 FT #HET 68 68 THR B 2 301 IBG B A 9 FT #HET 101 101 ASP B 1 301 IBG A S 4 FT #HET 107 107 ILE B 2 301 IBG B A 2 FT #HET 131 131 ARG B 1 301 IBG A S 3 FT #HET 212 212 TYR B 2 301 IBG B S 1 FT #HET 220 220 PHE B 2 301 IBG B S 6 FT DISORDER 1 3 FT DISORDER 221 222 CC SEQUENCE 217 AA (ATOM); CC RPKLHYPNGR GRMESVRWVL AAAGVEFDEE FLETKEQLYK LQDGNHLLFQ QVPMVEIDGM CC KLVQTRSILH YIADKHNLFG KNLKERTLID MYVEGTLDLL ELLIMHPFLK PDDQQKEVVN CC MAQKAIIRYF PVFEKILRGH GQSFLVGNQL SLADVILLQT ILALEEKIPN ILSAFPFLQE CC YTVKLSNIPT IKRFLEPGSK KKPPPDEIYV RTVYNIF CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES MAARPKLHYPNGRGRMESVRWVLAAAGVEFDEEFLETKEQLYKLQDGNHL CC ATOM ---RPKLHYPNGRGRMESVRWVLAAAGVEFDEEFLETKEQLYKLQDGNHL CC *********************************************** CC SEQRES LFQQVPMVEIDGMKLVQTRSILHYIADKHNLFGKNLKERTLIDMYVEGTL CC ATOM LFQQVPMVEIDGMKLVQTRSILHYIADKHNLFGKNLKERTLIDMYVEGTL CC ************************************************** CC SEQRES DLLELLIMHPFLKPDDQQKEVVNMAQKAIIRYFPVFEKILRGHGQSFLVG CC ATOM DLLELLIMHPFLKPDDQQKEVVNMAQKAIIRYFPVFEKILRGHGQSFLVG CC ************************************************** CC SEQRES NQLSLADVILLQTILALEEKIPNILSAFPFLQEYTVKLSNIPTIKRFLEP CC ATOM NQLSLADVILLQTILALEEKIPNILSAFPFLQEYTVKLSNIPTIKRFLEP CC ************************************************** CC SEQRES GSKKKPPPDEIYVRTVYNIFRP CC ATOM GSKKKPPPDEIYVRTVYNIF-- CC ******************** SQ SEQUENCE 222 AA; MW; CN; MAARPKLHYP NGRGRMESVR WVLAAAGVEF DEEFLETKEQ LYKLQDGNHL LFQQVPMVEI DGMKLVQTRS ILHYIADKHN LFGKNLKERT LIDMYVEGTL DLLELLIMHP FLKPDDQQKE VVNMAQKAII RYFPVFEKIL RGHGQSFLVG NQLSLADVIL LQTILALEEK IPNILSAFPF LQEYTVKLSN IPTIKRFLEP GSKKKPPPDE IYVRTVYNIF RP // ID 1GULC STANDARD; PRT; 222 AA. DT CONVERTED FROM PDB (SEQRES) 1GUL DE Glutathione S-transferase A4 OS Homo sapiens CC EXPDTA X-RAY DIFFRACTION CC RESOLU 2.700 CC R-Factor 0.250 FT #SUB 51 51 LEU C 135 135 VAL D Protein A 2 FT #SUB 52 52 PHE C 94 94 MET D Protein S 1 FT #SUB 52 52 PHE C 98 98 GLY D Protein S 1 FT #SUB 52 52 PHE C 131 131 ARG D Protein A 4 FT #SUB 52 52 PHE C 132 132 TYR D Protein S 5 FT #SUB 53 53 GLN C 131 131 ARG D Protein S 5 FT #SUB 54 54 GLN C 132 132 TYR D Protein S 1 FT #SUB 65 65 LEU C 94 94 MET D Protein A 4 FT #SUB 66 66 VAL C 94 94 MET D Protein A 7 FT #SUB 67 67 GLN C 97 97 GLU D Protein S 6 FT #SUB 67 67 GLN C 98 98 GLY D Protein S 3 FT #SUB 67 67 GLN C 101 101 ASP D Protein S 3 FT #SUB 69 69 ARG C 69 69 ARG D Protein S 4 FT #SUB 69 69 ARG C 97 97 GLU D Protein S 2 FT #SUB 70 70 SER C 93 93 ASP D Protein A 9 FT #SUB 70 70 SER C 94 94 MET D Protein S 3 FT #SUB 70 70 SER C 97 97 GLU D Protein S 2 FT #SUB 73 73 HIS C 73 73 HIS D Protein S 1 FT #SUB 73 73 HIS C 93 93 ASP D Protein S 6 FT #SUB 74 74 TYR C 87 87 LYS D Protein S 3 FT #SUB 74 74 TYR C 90 90 THR D Protein S 1 FT #SUB 78 78 LYS C 86 86 LEU D Protein S 1 FT #SUB 86 86 LEU C 74 74 TYR D Protein S 1 FT #SUB 86 86 LEU C 77 77 ASP D Protein S 1 FT #SUB 86 86 LEU C 78 78 LYS D Protein S 1 FT #SUB 87 87 LYS C 63 63 MET D Protein S 1 FT #SUB 87 87 LYS C 74 74 TYR D Protein S 3 FT #SUB 89 89 ARG C 89 89 ARG D Protein S 5 FT #SUB 90 90 THR C 65 65 LEU D Protein S 1 FT #SUB 90 90 THR C 74 74 TYR D Protein S 1 FT #SUB 93 93 ASP C 70 70 SER D Protein A 11 FT #SUB 93 93 ASP C 73 73 HIS D Protein S 7 FT #SUB 94 94 MET C 52 52 PHE D Protein B 1 FT #SUB 94 94 MET C 65 65 LEU D Protein S 4 FT #SUB 94 94 MET C 66 66 VAL D Protein S 7 FT #SUB 94 94 MET C 67 67 GLN D Protein B 1 FT #SUB 94 94 MET C 70 70 SER D Protein A 3 FT #SUB 95 95 TYR C 51 51 LEU D Protein S 1 FT #SUB 97 97 GLU C 67 67 GLN D Protein A 8 FT #SUB 97 97 GLU C 69 69 ARG D Protein S 2 FT #SUB 97 97 GLU C 70 70 SER D Protein S 2 FT #SUB 98 98 GLY C 52 52 PHE D Protein B 2 FT #SUB 98 98 GLY C 67 67 GLN D Protein B 4 FT #SUB 101 101 ASP C 67 67 GLN D Protein S 3 FT #SUB 131 131 ARG C 52 52 PHE D Protein A 4 FT #SUB 131 131 ARG C 53 53 GLN D Protein S 4 FT #SUB 132 132 TYR C 52 52 PHE D Protein S 5 FT #SUB 132 132 TYR C 54 54 GLN D Protein S 1 FT #SUB 135 135 VAL C 51 51 LEU D Protein S 2 FT #SUB 136 136 PHE C 52 52 PHE D Protein S 2 FT #SUB 59 59 GLU C 210 210 GLU G Protein S 1 FT #SUB 59 59 GLU C 211 211 ILE G Protein S 6 FT #HET 9 9 TYR C 3 301 IBG C S 1 FT #HET 15 15 ARG C 3 301 IBG C S 2 FT #HET 45 45 GLN C 3 301 IBG C S 1 FT #HET 53 53 GLN C 3 301 IBG C B 3 FT #HET 54 54 GLN C 3 301 IBG C A 14 FT #HET 55 55 VAL C 3 301 IBG C A 12 FT #HET 56 56 PRO C 3 301 IBG C S 1 FT #HET 67 67 GLN C 3 301 IBG C A 6 FT #HET 68 68 THR C 3 301 IBG C A 9 FT #HET 101 101 ASP C 4 301 IBG D S 4 FT #HET 107 107 ILE C 3 301 IBG C A 2 FT #HET 131 131 ARG C 4 301 IBG D S 4 FT #HET 212 212 TYR C 3 301 IBG C S 1 FT #HET 220 220 PHE C 3 301 IBG C S 6 FT DISORDER 1 3 FT DISORDER 221 222 CC SEQUENCE 217 AA (ATOM); CC RPKLHYPNGR GRMESVRWVL AAAGVEFDEE FLETKEQLYK LQDGNHLLFQ QVPMVEIDGM CC KLVQTRSILH YIADKHNLFG KNLKERTLID MYVEGTLDLL ELLIMHPFLK PDDQQKEVVN CC MAQKAIIRYF PVFEKILRGH GQSFLVGNQL SLADVILLQT ILALEEKIPN ILSAFPFLQE CC YTVKLSNIPT IKRFLEPGSK KKPPPDEIYV RTVYNIF CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES MAARPKLHYPNGRGRMESVRWVLAAAGVEFDEEFLETKEQLYKLQDGNHL CC ATOM ---RPKLHYPNGRGRMESVRWVLAAAGVEFDEEFLETKEQLYKLQDGNHL CC *********************************************** CC SEQRES LFQQVPMVEIDGMKLVQTRSILHYIADKHNLFGKNLKERTLIDMYVEGTL CC ATOM LFQQVPMVEIDGMKLVQTRSILHYIADKHNLFGKNLKERTLIDMYVEGTL CC ************************************************** CC SEQRES DLLELLIMHPFLKPDDQQKEVVNMAQKAIIRYFPVFEKILRGHGQSFLVG CC ATOM DLLELLIMHPFLKPDDQQKEVVNMAQKAIIRYFPVFEKILRGHGQSFLVG CC ************************************************** CC SEQRES NQLSLADVILLQTILALEEKIPNILSAFPFLQEYTVKLSNIPTIKRFLEP CC ATOM NQLSLADVILLQTILALEEKIPNILSAFPFLQEYTVKLSNIPTIKRFLEP CC ************************************************** CC SEQRES GSKKKPPPDEIYVRTVYNIFRP CC ATOM GSKKKPPPDEIYVRTVYNIF-- CC ******************** SQ SEQUENCE 222 AA; MW; CN; MAARPKLHYP NGRGRMESVR WVLAAAGVEF DEEFLETKEQ LYKLQDGNHL LFQQVPMVEI DGMKLVQTRS ILHYIADKHN LFGKNLKERT LIDMYVEGTL DLLELLIMHP FLKPDDQQKE VVNMAQKAII RYFPVFEKIL RGHGQSFLVG NQLSLADVIL LQTILALEEK IPNILSAFPF LQEYTVKLSN IPTIKRFLEP GSKKKPPPDE IYVRTVYNIF RP // ID 1GULD STANDARD; PRT; 222 AA. DT CONVERTED FROM PDB (SEQRES) 1GUL DE Glutathione S-transferase A4 OS Homo sapiens CC EXPDTA X-RAY DIFFRACTION CC RESOLU 2.700 CC R-Factor 0.250 FT #SUB 51 51 LEU D 95 95 TYR C Protein S 1 FT #SUB 51 51 LEU D 135 135 VAL C Protein A 2 FT #SUB 52 52 PHE D 94 94 MET C Protein S 1 FT #SUB 52 52 PHE D 98 98 GLY C Protein S 2 FT #SUB 52 52 PHE D 131 131 ARG C Protein A 4 FT #SUB 52 52 PHE D 132 132 TYR C Protein S 5 FT #SUB 52 52 PHE D 136 136 PHE C Protein S 2 FT #SUB 53 53 GLN D 131 131 ARG C Protein S 4 FT #SUB 54 54 GLN D 132 132 TYR C Protein S 1 FT #SUB 63 63 MET D 87 87 LYS C Protein S 1 FT #SUB 65 65 LEU D 90 90 THR C Protein S 1 FT #SUB 65 65 LEU D 94 94 MET C Protein A 4 FT #SUB 66 66 VAL D 94 94 MET C Protein A 7 FT #SUB 67 67 GLN D 94 94 MET C Protein S 1 FT #SUB 67 67 GLN D 97 97 GLU C Protein S 8 FT #SUB 67 67 GLN D 98 98 GLY C Protein S 4 FT #SUB 67 67 GLN D 101 101 ASP C Protein S 3 FT #SUB 69 69 ARG D 69 69 ARG C Protein S 4 FT #SUB 69 69 ARG D 97 97 GLU C Protein S 2 FT #SUB 70 70 SER D 93 93 ASP C Protein A 11 FT #SUB 70 70 SER D 94 94 MET C Protein S 3 FT #SUB 70 70 SER D 97 97 GLU C Protein S 2 FT #SUB 73 73 HIS D 73 73 HIS C Protein S 1 FT #SUB 73 73 HIS D 93 93 ASP C Protein S 7 FT #SUB 74 74 TYR D 86 86 LEU C Protein S 1 FT #SUB 74 74 TYR D 87 87 LYS C Protein S 3 FT #SUB 74 74 TYR D 90 90 THR C Protein S 1 FT #SUB 77 77 ASP D 86 86 LEU C Protein S 1 FT #SUB 78 78 LYS D 86 86 LEU C Protein S 1 FT #SUB 86 86 LEU D 78 78 LYS C Protein S 1 FT #SUB 87 87 LYS D 74 74 TYR C Protein S 3 FT #SUB 89 89 ARG D 89 89 ARG C Protein S 5 FT #SUB 90 90 THR D 74 74 TYR C Protein S 1 FT #SUB 93 93 ASP D 70 70 SER C Protein A 9 FT #SUB 93 93 ASP D 73 73 HIS C Protein S 6 FT #SUB 94 94 MET D 52 52 PHE C Protein B 1 FT #SUB 94 94 MET D 65 65 LEU C Protein S 4 FT #SUB 94 94 MET D 66 66 VAL C Protein S 7 FT #SUB 94 94 MET D 70 70 SER C Protein A 3 FT #SUB 97 97 GLU D 67 67 GLN C Protein A 6 FT #SUB 97 97 GLU D 69 69 ARG C Protein S 2 FT #SUB 97 97 GLU D 70 70 SER C Protein S 2 FT #SUB 98 98 GLY D 52 52 PHE C Protein B 1 FT #SUB 98 98 GLY D 67 67 GLN C Protein B 3 FT #SUB 101 101 ASP D 67 67 GLN C Protein S 3 FT #SUB 131 131 ARG D 52 52 PHE C Protein A 4 FT #SUB 131 131 ARG D 53 53 GLN C Protein S 5 FT #SUB 132 132 TYR D 52 52 PHE C Protein S 5 FT #SUB 132 132 TYR D 54 54 GLN C Protein S 1 FT #SUB 135 135 VAL D 51 51 LEU C Protein S 2 FT #HET 9 9 TYR D 4 301 IBG D S 1 FT #HET 15 15 ARG D 4 301 IBG D S 2 FT #HET 45 45 GLN D 4 301 IBG D S 1 FT #HET 53 53 GLN D 4 301 IBG D B 3 FT #HET 54 54 GLN D 4 301 IBG D A 14 FT #HET 55 55 VAL D 4 301 IBG D A 12 FT #HET 56 56 PRO D 4 301 IBG D S 1 FT #HET 67 67 GLN D 4 301 IBG D A 6 FT #HET 68 68 THR D 4 301 IBG D A 9 FT #HET 101 101 ASP D 3 301 IBG C S 4 FT #HET 107 107 ILE D 4 301 IBG D A 2 FT #HET 131 131 ARG D 3 301 IBG C S 2 FT #HET 212 212 TYR D 4 301 IBG D S 1 FT #HET 220 220 PHE D 4 301 IBG D S 6 FT DISORDER 1 3 FT DISORDER 221 222 CC SEQUENCE 217 AA (ATOM); CC RPKLHYPNGR GRMESVRWVL AAAGVEFDEE FLETKEQLYK LQDGNHLLFQ QVPMVEIDGM CC KLVQTRSILH YIADKHNLFG KNLKERTLID MYVEGTLDLL ELLIMHPFLK PDDQQKEVVN CC MAQKAIIRYF PVFEKILRGH GQSFLVGNQL SLADVILLQT ILALEEKIPN ILSAFPFLQE CC YTVKLSNIPT IKRFLEPGSK KKPPPDEIYV RTVYNIF CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES MAARPKLHYPNGRGRMESVRWVLAAAGVEFDEEFLETKEQLYKLQDGNHL CC ATOM ---RPKLHYPNGRGRMESVRWVLAAAGVEFDEEFLETKEQLYKLQDGNHL CC *********************************************** CC SEQRES LFQQVPMVEIDGMKLVQTRSILHYIADKHNLFGKNLKERTLIDMYVEGTL CC ATOM LFQQVPMVEIDGMKLVQTRSILHYIADKHNLFGKNLKERTLIDMYVEGTL CC ************************************************** CC SEQRES DLLELLIMHPFLKPDDQQKEVVNMAQKAIIRYFPVFEKILRGHGQSFLVG CC ATOM DLLELLIMHPFLKPDDQQKEVVNMAQKAIIRYFPVFEKILRGHGQSFLVG CC ************************************************** CC SEQRES NQLSLADVILLQTILALEEKIPNILSAFPFLQEYTVKLSNIPTIKRFLEP CC ATOM NQLSLADVILLQTILALEEKIPNILSAFPFLQEYTVKLSNIPTIKRFLEP CC ************************************************** CC SEQRES GSKKKPPPDEIYVRTVYNIFRP CC ATOM GSKKKPPPDEIYVRTVYNIF-- CC ******************** SQ SEQUENCE 222 AA; MW; CN; MAARPKLHYP NGRGRMESVR WVLAAAGVEF DEEFLETKEQ LYKLQDGNHL LFQQVPMVEI DGMKLVQTRS ILHYIADKHN LFGKNLKERT LIDMYVEGTL DLLELLIMHP FLKPDDQQKE VVNMAQKAII RYFPVFEKIL RGHGQSFLVG NQLSLADVIL LQTILALEEK IPNILSAFPF LQEYTVKLSN IPTIKRFLEP GSKKKPPPDE IYVRTVYNIF RP // ID 1GULE STANDARD; PRT; 222 AA. DT CONVERTED FROM PDB (SEQRES) 1GUL DE Glutathione S-transferase A4 OS Homo sapiens CC EXPDTA X-RAY DIFFRACTION CC RESOLU 2.700 CC R-Factor 0.250 FT #SUB 51 51 LEU E 95 95 TYR F Protein S 1 FT #SUB 51 51 LEU E 135 135 VAL F Protein A 2 FT #SUB 52 52 PHE E 94 94 MET F Protein S 1 FT #SUB 52 52 PHE E 98 98 GLY F Protein S 1 FT #SUB 52 52 PHE E 131 131 ARG F Protein A 4 FT #SUB 52 52 PHE E 132 132 TYR F Protein S 4 FT #SUB 52 52 PHE E 135 135 VAL F Protein S 1 FT #SUB 52 52 PHE E 136 136 PHE F Protein S 2 FT #SUB 53 53 GLN E 131 131 ARG F Protein S 3 FT #SUB 54 54 GLN E 132 132 TYR F Protein S 1 FT #SUB 63 63 MET E 87 87 LYS F Protein S 1 FT #SUB 65 65 LEU E 90 90 THR F Protein S 1 FT #SUB 65 65 LEU E 94 94 MET F Protein A 4 FT #SUB 66 66 VAL E 94 94 MET F Protein A 7 FT #SUB 67 67 GLN E 97 97 GLU F Protein S 7 FT #SUB 67 67 GLN E 98 98 GLY F Protein S 4 FT #SUB 67 67 GLN E 101 101 ASP F Protein S 3 FT #SUB 69 69 ARG E 69 69 ARG F Protein S 4 FT #SUB 69 69 ARG E 97 97 GLU F Protein S 2 FT #SUB 70 70 SER E 93 93 ASP F Protein A 11 FT #SUB 70 70 SER E 94 94 MET F Protein S 3 FT #SUB 70 70 SER E 97 97 GLU F Protein S 2 FT #SUB 73 73 HIS E 73 73 HIS F Protein S 1 FT #SUB 73 73 HIS E 93 93 ASP F Protein S 6 FT #SUB 74 74 TYR E 86 86 LEU F Protein S 1 FT #SUB 74 74 TYR E 87 87 LYS F Protein S 3 FT #SUB 74 74 TYR E 90 90 THR F Protein S 1 FT #SUB 78 78 LYS E 86 86 LEU F Protein S 1 FT #SUB 86 86 LEU E 74 74 TYR F Protein S 1 FT #SUB 86 86 LEU E 78 78 LYS F Protein S 1 FT #SUB 87 87 LYS E 63 63 MET F Protein S 1 FT #SUB 87 87 LYS E 74 74 TYR F Protein S 3 FT #SUB 89 89 ARG E 89 89 ARG F Protein S 5 FT #SUB 90 90 THR E 65 65 LEU F Protein S 1 FT #SUB 90 90 THR E 74 74 TYR F Protein S 1 FT #SUB 93 93 ASP E 70 70 SER F Protein A 10 FT #SUB 93 93 ASP E 73 73 HIS F Protein S 6 FT #SUB 94 94 MET E 52 52 PHE F Protein B 1 FT #SUB 94 94 MET E 65 65 LEU F Protein S 4 FT #SUB 94 94 MET E 66 66 VAL F Protein S 7 FT #SUB 94 94 MET E 70 70 SER F Protein A 3 FT #SUB 95 95 TYR E 51 51 LEU F Protein S 1 FT #SUB 97 97 GLU E 67 67 GLN F Protein A 6 FT #SUB 97 97 GLU E 69 69 ARG F Protein S 2 FT #SUB 97 97 GLU E 70 70 SER F Protein S 2 FT #SUB 98 98 GLY E 52 52 PHE F Protein B 1 FT #SUB 98 98 GLY E 67 67 GLN F Protein B 4 FT #SUB 101 101 ASP E 67 67 GLN F Protein S 3 FT #SUB 131 131 ARG E 52 52 PHE F Protein A 4 FT #SUB 131 131 ARG E 53 53 GLN F Protein S 3 FT #SUB 132 132 TYR E 52 52 PHE F Protein S 5 FT #SUB 135 135 VAL E 51 51 LEU F Protein S 2 FT #SUB 135 135 VAL E 52 52 PHE F Protein S 1 FT #SUB 136 136 PHE E 52 52 PHE F Protein S 2 FT #SUB 46 46 ASP E 141 141 ARG G Protein S 3 FT #HET 9 9 TYR E 5 301 IBG E S 1 FT #HET 15 15 ARG E 5 301 IBG E S 2 FT #HET 45 45 GLN E 5 301 IBG E S 1 FT #HET 53 53 GLN E 5 301 IBG E B 3 FT #HET 54 54 GLN E 5 301 IBG E A 14 FT #HET 55 55 VAL E 5 301 IBG E A 12 FT #HET 56 56 PRO E 5 301 IBG E S 1 FT #HET 67 67 GLN E 5 301 IBG E A 6 FT #HET 68 68 THR E 5 301 IBG E A 9 FT #HET 101 101 ASP E 6 301 IBG F S 4 FT #HET 107 107 ILE E 5 301 IBG E A 2 FT #HET 131 131 ARG E 6 301 IBG F S 4 FT #HET 212 212 TYR E 5 301 IBG E S 1 FT #HET 220 220 PHE E 5 301 IBG E S 6 FT DISORDER 1 3 FT DISORDER 221 222 CC SEQUENCE 217 AA (ATOM); CC RPKLHYPNGR GRMESVRWVL AAAGVEFDEE FLETKEQLYK LQDGNHLLFQ QVPMVEIDGM CC KLVQTRSILH YIADKHNLFG KNLKERTLID MYVEGTLDLL ELLIMHPFLK PDDQQKEVVN CC MAQKAIIRYF PVFEKILRGH GQSFLVGNQL SLADVILLQT ILALEEKIPN ILSAFPFLQE CC YTVKLSNIPT IKRFLEPGSK KKPPPDEIYV RTVYNIF CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES MAARPKLHYPNGRGRMESVRWVLAAAGVEFDEEFLETKEQLYKLQDGNHL CC ATOM ---RPKLHYPNGRGRMESVRWVLAAAGVEFDEEFLETKEQLYKLQDGNHL CC *********************************************** CC SEQRES LFQQVPMVEIDGMKLVQTRSILHYIADKHNLFGKNLKERTLIDMYVEGTL CC ATOM LFQQVPMVEIDGMKLVQTRSILHYIADKHNLFGKNLKERTLIDMYVEGTL CC ************************************************** CC SEQRES DLLELLIMHPFLKPDDQQKEVVNMAQKAIIRYFPVFEKILRGHGQSFLVG CC ATOM DLLELLIMHPFLKPDDQQKEVVNMAQKAIIRYFPVFEKILRGHGQSFLVG CC ************************************************** CC SEQRES NQLSLADVILLQTILALEEKIPNILSAFPFLQEYTVKLSNIPTIKRFLEP CC ATOM NQLSLADVILLQTILALEEKIPNILSAFPFLQEYTVKLSNIPTIKRFLEP CC ************************************************** CC SEQRES GSKKKPPPDEIYVRTVYNIFRP CC ATOM GSKKKPPPDEIYVRTVYNIF-- CC ******************** SQ SEQUENCE 222 AA; MW; CN; MAARPKLHYP NGRGRMESVR WVLAAAGVEF DEEFLETKEQ LYKLQDGNHL LFQQVPMVEI DGMKLVQTRS ILHYIADKHN LFGKNLKERT LIDMYVEGTL DLLELLIMHP FLKPDDQQKE VVNMAQKAII RYFPVFEKIL RGHGQSFLVG NQLSLADVIL LQTILALEEK IPNILSAFPF LQEYTVKLSN IPTIKRFLEP GSKKKPPPDE IYVRTVYNIF RP // ID 1GULF STANDARD; PRT; 222 AA. DT CONVERTED FROM PDB (SEQRES) 1GUL DE Glutathione S-transferase A4 OS Homo sapiens CC EXPDTA X-RAY DIFFRACTION CC RESOLU 2.700 CC R-Factor 0.250 FT #SUB 51 51 LEU F 95 95 TYR E Protein S 1 FT #SUB 51 51 LEU F 135 135 VAL E Protein A 2 FT #SUB 52 52 PHE F 94 94 MET E Protein S 1 FT #SUB 52 52 PHE F 98 98 GLY E Protein S 1 FT #SUB 52 52 PHE F 131 131 ARG E Protein A 4 FT #SUB 52 52 PHE F 132 132 TYR E Protein S 5 FT #SUB 52 52 PHE F 135 135 VAL E Protein S 1 FT #SUB 52 52 PHE F 136 136 PHE E Protein S 2 FT #SUB 53 53 GLN F 131 131 ARG E Protein S 3 FT #SUB 63 63 MET F 87 87 LYS E Protein S 1 FT #SUB 65 65 LEU F 90 90 THR E Protein S 1 FT #SUB 65 65 LEU F 94 94 MET E Protein A 4 FT #SUB 66 66 VAL F 94 94 MET E Protein A 7 FT #SUB 67 67 GLN F 97 97 GLU E Protein S 6 FT #SUB 67 67 GLN F 98 98 GLY E Protein S 4 FT #SUB 67 67 GLN F 101 101 ASP E Protein S 3 FT #SUB 69 69 ARG F 69 69 ARG E Protein S 4 FT #SUB 69 69 ARG F 97 97 GLU E Protein S 2 FT #SUB 70 70 SER F 93 93 ASP E Protein A 10 FT #SUB 70 70 SER F 94 94 MET E Protein S 3 FT #SUB 70 70 SER F 97 97 GLU E Protein S 2 FT #SUB 73 73 HIS F 73 73 HIS E Protein S 1 FT #SUB 73 73 HIS F 93 93 ASP E Protein S 6 FT #SUB 74 74 TYR F 86 86 LEU E Protein S 1 FT #SUB 74 74 TYR F 87 87 LYS E Protein S 3 FT #SUB 74 74 TYR F 90 90 THR E Protein S 1 FT #SUB 78 78 LYS F 86 86 LEU E Protein S 1 FT #SUB 86 86 LEU F 74 74 TYR E Protein S 1 FT #SUB 86 86 LEU F 78 78 LYS E Protein S 1 FT #SUB 87 87 LYS F 63 63 MET E Protein S 1 FT #SUB 87 87 LYS F 74 74 TYR E Protein S 3 FT #SUB 89 89 ARG F 89 89 ARG E Protein S 5 FT #SUB 90 90 THR F 65 65 LEU E Protein S 1 FT #SUB 90 90 THR F 74 74 TYR E Protein S 1 FT #SUB 93 93 ASP F 70 70 SER E Protein A 11 FT #SUB 93 93 ASP F 73 73 HIS E Protein S 6 FT #SUB 94 94 MET F 52 52 PHE E Protein B 1 FT #SUB 94 94 MET F 65 65 LEU E Protein S 4 FT #SUB 94 94 MET F 66 66 VAL E Protein S 7 FT #SUB 94 94 MET F 70 70 SER E Protein A 3 FT #SUB 95 95 TYR F 51 51 LEU E Protein S 1 FT #SUB 97 97 GLU F 67 67 GLN E Protein A 7 FT #SUB 97 97 GLU F 69 69 ARG E Protein S 2 FT #SUB 97 97 GLU F 70 70 SER E Protein S 2 FT #SUB 98 98 GLY F 52 52 PHE E Protein B 1 FT #SUB 98 98 GLY F 67 67 GLN E Protein B 4 FT #SUB 101 101 ASP F 67 67 GLN E Protein S 3 FT #SUB 131 131 ARG F 52 52 PHE E Protein A 4 FT #SUB 131 131 ARG F 53 53 GLN E Protein S 3 FT #SUB 132 132 TYR F 52 52 PHE E Protein S 4 FT #SUB 132 132 TYR F 54 54 GLN E Protein S 1 FT #SUB 135 135 VAL F 51 51 LEU E Protein S 2 FT #SUB 135 135 VAL F 52 52 PHE E Protein S 1 FT #SUB 136 136 PHE F 52 52 PHE E Protein S 2 FT #SUB 118 118 GLN F 118 118 GLN G Protein S 12 FT #SUB 122 122 VAL F 122 122 VAL G Protein S 1 FT #SUB 122 122 VAL F 171 171 ILE G Protein S 1 FT #SUB 126 126 GLN F 171 171 ILE G Protein S 1 FT #SUB 126 126 GLN F 173 173 ASN G Protein S 6 FT #SUB 129 129 ILE F 130 130 ILE G Protein S 2 FT #SUB 130 130 ILE F 129 129 ILE G Protein S 1 FT #SUB 171 171 ILE F 122 122 VAL G Protein S 1 FT #SUB 171 171 ILE F 126 126 GLN G Protein S 1 FT #SUB 173 173 ASN F 119 119 LYS G Protein S 3 FT #SUB 173 173 ASN F 123 123 ASN G Protein S 1 FT #SUB 173 173 ASN F 126 126 GLN G Protein A 4 FT #SUB 174 174 ILE F 126 126 GLN G Protein B 2 FT #SUB 176 176 SER F 126 126 GLN G Protein S 1 FT #SUB 177 177 ALA F 130 130 ILE G Protein S 1 FT #SUB 141 141 ARG F 46 46 ASP H Protein S 6 FT #SUB 179 179 PRO F 42 42 TYR H Protein S 6 FT #SUB 182 182 GLN F 42 42 TYR H Protein S 1 FT #HET 9 9 TYR F 6 301 IBG F S 1 FT #HET 15 15 ARG F 6 301 IBG F S 2 FT #HET 45 45 GLN F 6 301 IBG F S 1 FT #HET 53 53 GLN F 6 301 IBG F B 3 FT #HET 54 54 GLN F 6 301 IBG F A 14 FT #HET 55 55 VAL F 6 301 IBG F A 12 FT #HET 56 56 PRO F 6 301 IBG F S 1 FT #HET 67 67 GLN F 6 301 IBG F A 6 FT #HET 68 68 THR F 6 301 IBG F A 9 FT #HET 101 101 ASP F 5 301 IBG E S 4 FT #HET 107 107 ILE F 6 301 IBG F A 2 FT #HET 131 131 ARG F 5 301 IBG E S 4 FT #HET 212 212 TYR F 6 301 IBG F S 1 FT #HET 220 220 PHE F 6 301 IBG F S 6 FT DISORDER 1 3 FT DISORDER 221 222 CC SEQUENCE 217 AA (ATOM); CC RPKLHYPNGR GRMESVRWVL AAAGVEFDEE FLETKEQLYK LQDGNHLLFQ QVPMVEIDGM CC KLVQTRSILH YIADKHNLFG KNLKERTLID MYVEGTLDLL ELLIMHPFLK PDDQQKEVVN CC MAQKAIIRYF PVFEKILRGH GQSFLVGNQL SLADVILLQT ILALEEKIPN ILSAFPFLQE CC YTVKLSNIPT IKRFLEPGSK KKPPPDEIYV RTVYNIF CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES MAARPKLHYPNGRGRMESVRWVLAAAGVEFDEEFLETKEQLYKLQDGNHL CC ATOM ---RPKLHYPNGRGRMESVRWVLAAAGVEFDEEFLETKEQLYKLQDGNHL CC *********************************************** CC SEQRES LFQQVPMVEIDGMKLVQTRSILHYIADKHNLFGKNLKERTLIDMYVEGTL CC ATOM LFQQVPMVEIDGMKLVQTRSILHYIADKHNLFGKNLKERTLIDMYVEGTL CC ************************************************** CC SEQRES DLLELLIMHPFLKPDDQQKEVVNMAQKAIIRYFPVFEKILRGHGQSFLVG CC ATOM DLLELLIMHPFLKPDDQQKEVVNMAQKAIIRYFPVFEKILRGHGQSFLVG CC ************************************************** CC SEQRES NQLSLADVILLQTILALEEKIPNILSAFPFLQEYTVKLSNIPTIKRFLEP CC ATOM NQLSLADVILLQTILALEEKIPNILSAFPFLQEYTVKLSNIPTIKRFLEP CC ************************************************** CC SEQRES GSKKKPPPDEIYVRTVYNIFRP CC ATOM GSKKKPPPDEIYVRTVYNIF-- CC ******************** SQ SEQUENCE 222 AA; MW; CN; MAARPKLHYP NGRGRMESVR WVLAAAGVEF DEEFLETKEQ LYKLQDGNHL LFQQVPMVEI DGMKLVQTRS ILHYIADKHN LFGKNLKERT LIDMYVEGTL DLLELLIMHP FLKPDDQQKE VVNMAQKAII RYFPVFEKIL RGHGQSFLVG NQLSLADVIL LQTILALEEK IPNILSAFPF LQEYTVKLSN IPTIKRFLEP GSKKKPPPDE IYVRTVYNIF RP // ID 1GULG STANDARD; PRT; 222 AA. DT CONVERTED FROM PDB (SEQRES) 1GUL DE Glutathione S-transferase A4 OS Homo sapiens CC EXPDTA X-RAY DIFFRACTION CC RESOLU 2.700 CC R-Factor 0.250 FT #SUB 146 146 SER G 200 200 PRO B Protein S 2 FT #SUB 147 147 PHE G 200 200 PRO B Protein S 1 FT #SUB 191 191 ILE G 200 200 PRO B Protein S 1 FT #SUB 191 191 ILE G 201 201 GLY B Protein S 2 FT #SUB 192 192 PRO G 201 201 GLY B Protein S 5 FT #SUB 210 210 GLU G 59 59 GLU C Protein S 1 FT #SUB 211 211 ILE G 59 59 GLU C Protein S 6 FT #SUB 141 141 ARG G 46 46 ASP E Protein S 3 FT #SUB 118 118 GLN G 118 118 GLN F Protein S 12 FT #SUB 119 119 LYS G 173 173 ASN F Protein S 3 FT #SUB 122 122 VAL G 122 122 VAL F Protein S 1 FT #SUB 122 122 VAL G 171 171 ILE F Protein S 1 FT #SUB 123 123 ASN G 173 173 ASN F Protein S 1 FT #SUB 126 126 GLN G 171 171 ILE F Protein S 1 FT #SUB 126 126 GLN G 173 173 ASN F Protein S 4 FT #SUB 126 126 GLN G 174 174 ILE F Protein S 2 FT #SUB 126 126 GLN G 176 176 SER F Protein S 1 FT #SUB 129 129 ILE G 130 130 ILE F Protein S 1 FT #SUB 130 130 ILE G 129 129 ILE F Protein S 2 FT #SUB 130 130 ILE G 177 177 ALA F Protein S 1 FT #SUB 171 171 ILE G 122 122 VAL F Protein S 1 FT #SUB 171 171 ILE G 126 126 GLN F Protein S 1 FT #SUB 173 173 ASN G 126 126 GLN F Protein A 6 FT #SUB 51 51 LEU G 95 95 TYR H Protein S 1 FT #SUB 51 51 LEU G 135 135 VAL H Protein A 2 FT #SUB 52 52 PHE G 94 94 MET H Protein S 1 FT #SUB 52 52 PHE G 98 98 GLY H Protein S 1 FT #SUB 52 52 PHE G 131 131 ARG H Protein B 3 FT #SUB 52 52 PHE G 132 132 TYR H Protein S 4 FT #SUB 52 52 PHE G 136 136 PHE H Protein S 1 FT #SUB 53 53 GLN G 131 131 ARG H Protein S 4 FT #SUB 54 54 GLN G 132 132 TYR H Protein S 1 FT #SUB 65 65 LEU G 94 94 MET H Protein A 4 FT #SUB 66 66 VAL G 94 94 MET H Protein A 7 FT #SUB 67 67 GLN G 97 97 GLU H Protein S 7 FT #SUB 67 67 GLN G 98 98 GLY H Protein S 3 FT #SUB 67 67 GLN G 101 101 ASP H Protein S 3 FT #SUB 69 69 ARG G 69 69 ARG H Protein S 4 FT #SUB 69 69 ARG G 97 97 GLU H Protein S 2 FT #SUB 70 70 SER G 93 93 ASP H Protein A 10 FT #SUB 70 70 SER G 94 94 MET H Protein S 3 FT #SUB 70 70 SER G 97 97 GLU H Protein S 2 FT #SUB 73 73 HIS G 93 93 ASP H Protein S 6 FT #SUB 74 74 TYR G 87 87 LYS H Protein S 2 FT #SUB 74 74 TYR G 90 90 THR H Protein S 1 FT #SUB 78 78 LYS G 86 86 LEU H Protein S 1 FT #SUB 86 86 LEU G 78 78 LYS H Protein S 1 FT #SUB 87 87 LYS G 74 74 TYR H Protein S 2 FT #SUB 89 89 ARG G 89 89 ARG H Protein S 3 FT #SUB 93 93 ASP G 70 70 SER H Protein A 7 FT #SUB 93 93 ASP G 73 73 HIS H Protein S 6 FT #SUB 94 94 MET G 52 52 PHE H Protein B 1 FT #SUB 94 94 MET G 65 65 LEU H Protein S 4 FT #SUB 94 94 MET G 66 66 VAL H Protein S 7 FT #SUB 94 94 MET G 70 70 SER H Protein A 3 FT #SUB 97 97 GLU G 67 67 GLN H Protein A 6 FT #SUB 97 97 GLU G 69 69 ARG H Protein S 1 FT #SUB 97 97 GLU G 70 70 SER H Protein S 2 FT #SUB 98 98 GLY G 52 52 PHE H Protein B 1 FT #SUB 98 98 GLY G 67 67 GLN H Protein B 3 FT #SUB 101 101 ASP G 67 67 GLN H Protein S 3 FT #SUB 131 131 ARG G 52 52 PHE H Protein A 4 FT #SUB 131 131 ARG G 53 53 GLN H Protein S 4 FT #SUB 132 132 TYR G 52 52 PHE H Protein S 5 FT #SUB 132 132 TYR G 54 54 GLN H Protein S 1 FT #SUB 135 135 VAL G 51 51 LEU H Protein S 2 FT #HET 9 9 TYR G 7 301 IBG G S 1 FT #HET 15 15 ARG G 7 301 IBG G S 2 FT #HET 45 45 GLN G 7 301 IBG G S 1 FT #HET 53 53 GLN G 7 301 IBG G B 3 FT #HET 54 54 GLN G 7 301 IBG G A 14 FT #HET 55 55 VAL G 7 301 IBG G A 12 FT #HET 56 56 PRO G 7 301 IBG G S 1 FT #HET 67 67 GLN G 7 301 IBG G A 6 FT #HET 68 68 THR G 7 301 IBG G A 9 FT #HET 101 101 ASP G 8 301 IBG H S 4 FT #HET 107 107 ILE G 7 301 IBG G A 2 FT #HET 131 131 ARG G 8 301 IBG H S 4 FT #HET 212 212 TYR G 7 301 IBG G S 1 FT #HET 220 220 PHE G 7 301 IBG G S 6 FT DISORDER 1 3 FT DISORDER 221 222 CC SEQUENCE 217 AA (ATOM); CC RPKLHYPNGR GRMESVRWVL AAAGVEFDEE FLETKEQLYK LQDGNHLLFQ QVPMVEIDGM CC KLVQTRSILH YIADKHNLFG KNLKERTLID MYVEGTLDLL ELLIMHPFLK PDDQQKEVVN CC MAQKAIIRYF PVFEKILRGH GQSFLVGNQL SLADVILLQT ILALEEKIPN ILSAFPFLQE CC YTVKLSNIPT IKRFLEPGSK KKPPPDEIYV RTVYNIF CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES MAARPKLHYPNGRGRMESVRWVLAAAGVEFDEEFLETKEQLYKLQDGNHL CC ATOM ---RPKLHYPNGRGRMESVRWVLAAAGVEFDEEFLETKEQLYKLQDGNHL CC *********************************************** CC SEQRES LFQQVPMVEIDGMKLVQTRSILHYIADKHNLFGKNLKERTLIDMYVEGTL CC ATOM LFQQVPMVEIDGMKLVQTRSILHYIADKHNLFGKNLKERTLIDMYVEGTL CC ************************************************** CC SEQRES DLLELLIMHPFLKPDDQQKEVVNMAQKAIIRYFPVFEKILRGHGQSFLVG CC ATOM DLLELLIMHPFLKPDDQQKEVVNMAQKAIIRYFPVFEKILRGHGQSFLVG CC ************************************************** CC SEQRES NQLSLADVILLQTILALEEKIPNILSAFPFLQEYTVKLSNIPTIKRFLEP CC ATOM NQLSLADVILLQTILALEEKIPNILSAFPFLQEYTVKLSNIPTIKRFLEP CC ************************************************** CC SEQRES GSKKKPPPDEIYVRTVYNIFRP CC ATOM GSKKKPPPDEIYVRTVYNIF-- CC ******************** SQ SEQUENCE 222 AA; MW; CN; MAARPKLHYP NGRGRMESVR WVLAAAGVEF DEEFLETKEQ LYKLQDGNHL LFQQVPMVEI DGMKLVQTRS ILHYIADKHN LFGKNLKERT LIDMYVEGTL DLLELLIMHP FLKPDDQQKE VVNMAQKAII RYFPVFEKIL RGHGQSFLVG NQLSLADVIL LQTILALEEK IPNILSAFPF LQEYTVKLSN IPTIKRFLEP GSKKKPPPDE IYVRTVYNIF RP // ID 1GULH STANDARD; PRT; 222 AA. DT CONVERTED FROM PDB (SEQRES) 1GUL DE Glutathione S-transferase A4 OS Homo sapiens CC EXPDTA X-RAY DIFFRACTION CC RESOLU 2.700 CC R-Factor 0.250 FT #SUB 42 42 TYR H 179 179 PRO F Protein S 6 FT #SUB 42 42 TYR H 182 182 GLN F Protein S 1 FT #SUB 46 46 ASP H 141 141 ARG F Protein S 6 FT #SUB 51 51 LEU H 135 135 VAL G Protein A 2 FT #SUB 52 52 PHE H 94 94 MET G Protein S 1 FT #SUB 52 52 PHE H 98 98 GLY G Protein S 1 FT #SUB 52 52 PHE H 131 131 ARG G Protein A 4 FT #SUB 52 52 PHE H 132 132 TYR G Protein S 5 FT #SUB 53 53 GLN H 131 131 ARG G Protein S 4 FT #SUB 54 54 GLN H 132 132 TYR G Protein S 1 FT #SUB 65 65 LEU H 94 94 MET G Protein A 4 FT #SUB 66 66 VAL H 94 94 MET G Protein A 7 FT #SUB 67 67 GLN H 97 97 GLU G Protein S 6 FT #SUB 67 67 GLN H 98 98 GLY G Protein S 3 FT #SUB 67 67 GLN H 101 101 ASP G Protein S 3 FT #SUB 69 69 ARG H 69 69 ARG G Protein S 4 FT #SUB 69 69 ARG H 97 97 GLU G Protein S 1 FT #SUB 70 70 SER H 93 93 ASP G Protein A 7 FT #SUB 70 70 SER H 94 94 MET G Protein S 3 FT #SUB 70 70 SER H 97 97 GLU G Protein S 2 FT #SUB 73 73 HIS H 93 93 ASP G Protein S 6 FT #SUB 74 74 TYR H 87 87 LYS G Protein S 2 FT #SUB 78 78 LYS H 86 86 LEU G Protein S 1 FT #SUB 86 86 LEU H 78 78 LYS G Protein S 1 FT #SUB 87 87 LYS H 74 74 TYR G Protein S 2 FT #SUB 89 89 ARG H 89 89 ARG G Protein S 3 FT #SUB 90 90 THR H 74 74 TYR G Protein S 1 FT #SUB 93 93 ASP H 70 70 SER G Protein A 10 FT #SUB 93 93 ASP H 73 73 HIS G Protein S 6 FT #SUB 94 94 MET H 52 52 PHE G Protein B 1 FT #SUB 94 94 MET H 65 65 LEU G Protein S 4 FT #SUB 94 94 MET H 66 66 VAL G Protein S 7 FT #SUB 94 94 MET H 70 70 SER G Protein A 3 FT #SUB 95 95 TYR H 51 51 LEU G Protein S 1 FT #SUB 97 97 GLU H 67 67 GLN G Protein A 7 FT #SUB 97 97 GLU H 69 69 ARG G Protein S 2 FT #SUB 97 97 GLU H 70 70 SER G Protein S 2 FT #SUB 98 98 GLY H 52 52 PHE G Protein B 1 FT #SUB 98 98 GLY H 67 67 GLN G Protein B 3 FT #SUB 101 101 ASP H 67 67 GLN G Protein S 3 FT #SUB 131 131 ARG H 52 52 PHE G Protein S 3 FT #SUB 131 131 ARG H 53 53 GLN G Protein S 4 FT #SUB 132 132 TYR H 52 52 PHE G Protein S 4 FT #SUB 132 132 TYR H 54 54 GLN G Protein S 1 FT #SUB 135 135 VAL H 51 51 LEU G Protein S 2 FT #SUB 136 136 PHE H 52 52 PHE G Protein S 1 FT #HET 9 9 TYR H 8 301 IBG H S 1 FT #HET 15 15 ARG H 8 301 IBG H S 2 FT #HET 45 45 GLN H 8 301 IBG H S 1 FT #HET 53 53 GLN H 8 301 IBG H B 3 FT #HET 54 54 GLN H 8 301 IBG H A 14 FT #HET 55 55 VAL H 8 301 IBG H A 12 FT #HET 56 56 PRO H 8 301 IBG H S 1 FT #HET 67 67 GLN H 8 301 IBG H A 6 FT #HET 68 68 THR H 8 301 IBG H A 9 FT #HET 101 101 ASP H 7 301 IBG G S 4 FT #HET 107 107 ILE H 8 301 IBG H A 2 FT #HET 131 131 ARG H 7 301 IBG G S 4 FT #HET 212 212 TYR H 8 301 IBG H S 1 FT #HET 220 220 PHE H 8 301 IBG H S 6 FT DISORDER 1 3 FT DISORDER 221 222 CC SEQUENCE 217 AA (ATOM); CC RPKLHYPNGR GRMESVRWVL AAAGVEFDEE FLETKEQLYK LQDGNHLLFQ QVPMVEIDGM CC KLVQTRSILH YIADKHNLFG KNLKERTLID MYVEGTLDLL ELLIMHPFLK PDDQQKEVVN CC MAQKAIIRYF PVFEKILRGH GQSFLVGNQL SLADVILLQT ILALEEKIPN ILSAFPFLQE CC YTVKLSNIPT IKRFLEPGSK KKPPPDEIYV RTVYNIF CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES MAARPKLHYPNGRGRMESVRWVLAAAGVEFDEEFLETKEQLYKLQDGNHL CC ATOM ---RPKLHYPNGRGRMESVRWVLAAAGVEFDEEFLETKEQLYKLQDGNHL CC *********************************************** CC SEQRES LFQQVPMVEIDGMKLVQTRSILHYIADKHNLFGKNLKERTLIDMYVEGTL CC ATOM LFQQVPMVEIDGMKLVQTRSILHYIADKHNLFGKNLKERTLIDMYVEGTL CC ************************************************** CC SEQRES DLLELLIMHPFLKPDDQQKEVVNMAQKAIIRYFPVFEKILRGHGQSFLVG CC ATOM DLLELLIMHPFLKPDDQQKEVVNMAQKAIIRYFPVFEKILRGHGQSFLVG CC ************************************************** CC SEQRES NQLSLADVILLQTILALEEKIPNILSAFPFLQEYTVKLSNIPTIKRFLEP CC ATOM NQLSLADVILLQTILALEEKIPNILSAFPFLQEYTVKLSNIPTIKRFLEP CC ************************************************** CC SEQRES GSKKKPPPDEIYVRTVYNIFRP CC ATOM GSKKKPPPDEIYVRTVYNIF-- CC ******************** SQ SEQUENCE 222 AA; MW; CN; MAARPKLHYP NGRGRMESVR WVLAAAGVEF DEEFLETKEQ LYKLQDGNHL LFQQVPMVEI DGMKLVQTRS ILHYIADKHN LFGKNLKERT LIDMYVEGTL DLLELLIMHP FLKPDDQQKE VVNMAQKAII RYFPVFEKIL RGHGQSFLVG NQLSLADVIL LQTILALEEK IPNILSAFPF LQEYTVKLSN IPTIKRFLEP GSKKKPPPDE IYVRTVYNIF RP //