3k5k A 1.7 BS01 ZN A 1 C974 C987 C1017 C1021 C58 C71 C101 C105 Y1067 Y1154 Y151 Y236 2.1.1.-,2.1.1.367 0002039,0005634,0008270,0016279,0042054 Q96KQ7 19891491 1194 RTEKIICRDVARGYENVPIPCVNGVDGEPCPEDYKYISENCETSTMNIDRNITHLQHCTCVDDCSSSNCLCGQLSIRCWYDKDGRLLQEFNKIEPPLIFECNQACSCWRNCKNRVVQSGIKVRLQLYRTAKMGWGVRALQTIPQGTFICEYVGELISDAEADVREDDSYLFDLDNKEVYCIDARYYGNISRFINHLCDPNIIPVRVFMLHQDLRFPRIAFFSSRDIRTGEELGFDYGDRFWDIKSKYFTCQCGSEKCKHSAEAIALEQSRLA 3k5k A 1.7 BS02 ZN A 2 C980 C1017 C1023 C1027 C64 C101 C107 C111 Y1067 Y1154 Y151 Y236 2.1.1.-,2.1.1.367 0002039,0005634,0008270,0016279,0042054 Q96KQ7 19891491 1195 RTEKIICRDVARGYENVPIPCVNGVDGEPCPEDYKYISENCETSTMNIDRNITHLQHCTCVDDCSSSNCLCGQLSIRCWYDKDGRLLQEFNKIEPPLIFECNQACSCWRNCKNRVVQSGIKVRLQLYRTAKMGWGVRALQTIPQGTFICEYVGELISDAEADVREDDSYLFDLDNKEVYCIDARYYGNISRFINHLCDPNIIPVRVFMLHQDLRFPRIAFFSSRDIRTGEELGFDYGDRFWDIKSKYFTCQCGSEKCKHSAEAIALEQSRLA 3k5k A 1.7 BS03 ZN A 3 C974 C976 C980 C985 C58 C60 C64 C69 Y1067 Y1154 Y151 Y236 2.1.1.-,2.1.1.367 0002039,0005634,0008270,0016279,0042054 Q96KQ7 19891491 1196 RTEKIICRDVARGYENVPIPCVNGVDGEPCPEDYKYISENCETSTMNIDRNITHLQHCTCVDDCSSSNCLCGQLSIRCWYDKDGRLLQEFNKIEPPLIFECNQACSCWRNCKNRVVQSGIKVRLQLYRTAKMGWGVRALQTIPQGTFICEYVGELISDAEADVREDDSYLFDLDNKEVYCIDARYYGNISRFINHLCDPNIIPVRVFMLHQDLRFPRIAFFSSRDIRTGEELGFDYGDRFWDIKSKYFTCQCGSEKCKHSAEAIALEQSRLA 3k5k A 1.7 BS04 ZN A 4 C1115 C1168 C1170 C1175 C197 C250 C252 C257 Y1067 Y1154 Y151 Y236 2.1.1.-,2.1.1.367 0002039,0005634,0008270,0016279,0042054 Q96KQ7 19891491 1197 RTEKIICRDVARGYENVPIPCVNGVDGEPCPEDYKYISENCETSTMNIDRNITHLQHCTCVDDCSSSNCLCGQLSIRCWYDKDGRLLQEFNKIEPPLIFECNQACSCWRNCKNRVVQSGIKVRLQLYRTAKMGWGVRALQTIPQGTFICEYVGELISDAEADVREDDSYLFDLDNKEVYCIDARYYGNISRFINHLCDPNIIPVRVFMLHQDLRFPRIAFFSSRDIRTGEELGFDYGDRFWDIKSKYFTCQCGSEKCKHSAEAIALEQSRLA 3k5k A 1.7 BS05 SAH A 1 M1048 W1050 Y1085 R1109 F1110 N1112 H1113 Y1154 F1158 F1166 C1168 Q1169 M132 W134 Y169 R191 F192 N194 H195 Y236 F240 F248 C250 Q251 Y1067 Y1154 Y151 Y236 2.1.1.-,2.1.1.367 0002039,0005634,0008270,0016279,0042054 Ki=570nM, IC50=2000nM Q96KQ7 19891491 1198 RTEKIICRDVARGYENVPIPCVNGVDGEPCPEDYKYISENCETSTMNIDRNITHLQHCTCVDDCSSSNCLCGQLSIRCWYDKDGRLLQEFNKIEPPLIFECNQACSCWRNCKNRVVQSGIKVRLQLYRTAKMGWGVRALQTIPQGTFICEYVGELISDAEADVREDDSYLFDLDNKEVYCIDARYYGNISRFINHLCDPNIIPVRVFMLHQDLRFPRIAFFSSRDIRTGEELGFDYGDRFWDIKSKYFTCQCGSEKCKHSAEAIALEQSRLA 3k5k A 1.7 BS06 DXQ A 1 D1074 A1077 D1078 D1083 L1086 D1088 F1152 Y1154 R1157 F1158 D158 A161 D162 D167 L170 D172 F234 Y236 R239 F240 Y1067 Y1154 Y151 Y236 2.1.1.-,2.1.1.367 0002039,0005634,0008270,0016279,0042054 Kd=23nM -logKd/Ki=7.64, Kd=23nM IC50=15nM, Ki=2.6nM, Kd=23nM Q96KQ7 19891491 2000 RTEKIICRDVARGYENVPIPCVNGVDGEPCPEDYKYISENCETSTMNIDRNITHLQHCTCVDDCSSSNCLCGQLSIRCWYDKDGRLLQEFNKIEPPLIFECNQACSCWRNCKNRVVQSGIKVRLQLYRTAKMGWGVRALQTIPQGTFICEYVGELISDAEADVREDDSYLFDLDNKEVYCIDARYYGNISRFINHLCDPNIIPVRVFMLHQDLRFPRIAFFSSRDIRTGEELGFDYGDRFWDIKSKYFTCQCGSEKCKHSAEAIALEQSRLA 3k5k B 1.7 BS01 ZN B 1 C974 C987 C1017 C1021 C56 C69 C99 C103 Y1067 Y1154 Y149 Y233 2.1.1.-,2.1.1.367 0002039,0005634,0008270,0016279,0042054 Q96KQ7 19891491 1194 EKIICRDVARGYENVPIPCVNGVDGEPCPEDYKYISENCETSTMNIDRNITHLQHCTCVDDCSSSNCLCGQLSIRCWYDKDGRLLQEFNKIEPPLIFECNQACSCWRNCKNRVVQSGIKVRLQLYRTAKMGWGVRALQTIPQGTFICEYVGELISDAEADVREDDSYLFDLDNEVYCIDARYYGNISRFINHLCDPNIIPVRVFMLHQDLRFPRIAFFSSRDIRTGEELGFDYGDRFWDIKSKYFTCQCGSEKCKHSAEAIALEQSRLA 3k5k B 1.7 BS02 ZN B 2 C980 C1017 C1023 C1027 C62 C99 C105 C109 Y1067 Y1154 Y149 Y233 2.1.1.-,2.1.1.367 0002039,0005634,0008270,0016279,0042054 Q96KQ7 19891491 1195 EKIICRDVARGYENVPIPCVNGVDGEPCPEDYKYISENCETSTMNIDRNITHLQHCTCVDDCSSSNCLCGQLSIRCWYDKDGRLLQEFNKIEPPLIFECNQACSCWRNCKNRVVQSGIKVRLQLYRTAKMGWGVRALQTIPQGTFICEYVGELISDAEADVREDDSYLFDLDNEVYCIDARYYGNISRFINHLCDPNIIPVRVFMLHQDLRFPRIAFFSSRDIRTGEELGFDYGDRFWDIKSKYFTCQCGSEKCKHSAEAIALEQSRLA 3k5k B 1.7 BS03 ZN B 3 C974 C976 C980 C985 C56 C58 C62 C67 Y1067 Y1154 Y149 Y233 2.1.1.-,2.1.1.367 0002039,0005634,0008270,0016279,0042054 Q96KQ7 19891491 1196 EKIICRDVARGYENVPIPCVNGVDGEPCPEDYKYISENCETSTMNIDRNITHLQHCTCVDDCSSSNCLCGQLSIRCWYDKDGRLLQEFNKIEPPLIFECNQACSCWRNCKNRVVQSGIKVRLQLYRTAKMGWGVRALQTIPQGTFICEYVGELISDAEADVREDDSYLFDLDNEVYCIDARYYGNISRFINHLCDPNIIPVRVFMLHQDLRFPRIAFFSSRDIRTGEELGFDYGDRFWDIKSKYFTCQCGSEKCKHSAEAIALEQSRLA 3k5k B 1.7 BS04 ZN B 4 C1115 C1168 C1170 C1175 C194 C247 C249 C254 Y1067 Y1154 Y149 Y233 2.1.1.-,2.1.1.367 0002039,0005634,0008270,0016279,0042054 Q96KQ7 19891491 1197 EKIICRDVARGYENVPIPCVNGVDGEPCPEDYKYISENCETSTMNIDRNITHLQHCTCVDDCSSSNCLCGQLSIRCWYDKDGRLLQEFNKIEPPLIFECNQACSCWRNCKNRVVQSGIKVRLQLYRTAKMGWGVRALQTIPQGTFICEYVGELISDAEADVREDDSYLFDLDNEVYCIDARYYGNISRFINHLCDPNIIPVRVFMLHQDLRFPRIAFFSSRDIRTGEELGFDYGDRFWDIKSKYFTCQCGSEKCKHSAEAIALEQSRLA 3k5k B 1.7 BS05 SAH B 1 M1048 W1050 S1084 Y1085 R1109 F1110 N1112 H1113 Y1154 F1158 F1166 C1168 Q1169 M130 W132 S166 Y167 R188 F189 N191 H192 Y233 F237 F245 C247 Q248 Y1067 Y1154 Y149 Y233 2.1.1.-,2.1.1.367 0002039,0005634,0008270,0016279,0042054 Ki=570nM, IC50=2000nM Q96KQ7 19891491 1198 EKIICRDVARGYENVPIPCVNGVDGEPCPEDYKYISENCETSTMNIDRNITHLQHCTCVDDCSSSNCLCGQLSIRCWYDKDGRLLQEFNKIEPPLIFECNQACSCWRNCKNRVVQSGIKVRLQLYRTAKMGWGVRALQTIPQGTFICEYVGELISDAEADVREDDSYLFDLDNEVYCIDARYYGNISRFINHLCDPNIIPVRVFMLHQDLRFPRIAFFSSRDIRTGEELGFDYGDRFWDIKSKYFTCQCGSEKCKHSAEAIALEQSRLA 3k5k B 1.7 BS06 DXQ B 1 D1074 A1077 D1078 D1083 L1086 D1088 F1152 F1158 D156 A159 D160 D165 L168 D170 F231 F237 Y1067 Y1154 Y149 Y233 2.1.1.-,2.1.1.367 0002039,0005634,0008270,0016279,0042054 Kd=23nM IC50=15nM, Ki=2.6nM, Kd=23nM Q96KQ7 19891491 2001 EKIICRDVARGYENVPIPCVNGVDGEPCPEDYKYISENCETSTMNIDRNITHLQHCTCVDDCSSSNCLCGQLSIRCWYDKDGRLLQEFNKIEPPLIFECNQACSCWRNCKNRVVQSGIKVRLQLYRTAKMGWGVRALQTIPQGTFICEYVGELISDAEADVREDDSYLFDLDNEVYCIDARYYGNISRFINHLCDPNIIPVRVFMLHQDLRFPRIAFFSSRDIRTGEELGFDYGDRFWDIKSKYFTCQCGSEKCKHSAEAIALEQSRLA