PMID- 28740863 OWN - NLM STAT- MEDLINE DCOM- 20190701 LR - 20190701 IS - 2375-2548 (Electronic) IS - 2375-2548 (Linking) VI - 3 IP - 7 DP - 2017 Jul TI - A nanosecond time-resolved XFEL analysis of structural changes associated with CO release from cytochrome c oxidase. PG - e1603042 LID - 10.1126/sciadv.1603042 [doi] LID - e1603042 AB - Bovine cytochrome c oxidase (CcO), a 420-kDa membrane protein, pumps protons using electrostatic repulsion between protons transferred through a water channel and net positive charges created by oxidation of heme a (Fe (a) ) for reduction of O(2) at heme a(3) (Fe (a3)). For this process to function properly, timing is essential: The channel must be closed after collection of the protons to be pumped and before Fe (a) oxidation. If the channel were to remain open, spontaneous backflow of the collected protons would occur. For elucidation of the channel closure mechanism, the opening of the channel, which occurs upon release of CO from CcO, is investigated by newly developed time-resolved x-ray free-electron laser and infrared techniques with nanosecond time resolution. The opening process indicates that Cu(B) senses completion of proton collection and binds O(2) before binding to Fe (a3) to close the water channel using a conformational relay system, which includes Cu(B), heme a(3), and a transmembrane helix, to block backflow of the collected protons. FAU - Shimada, Atsuhiro AU - Shimada A AD - Picobiology Institute, Graduate School of Life Science, University of Hyogo, 3-2-1 Kouto, Kamigori-cho, Ako-gun, Hyogo 678-1297, Japan. FAU - Kubo, Minoru AU - Kubo M AUID- ORCID: 0000-0002-1470-942X AD - RIKEN SPring-8 Center, 1-1-1 Kouto, Sayo-cho, Sayo-gun, Hyogo 679-5148, Japan. AD - Japan Science and Technology Agency, Precursory Research for Embryonic Science and Technology (PRESTO), 4-1-8 Honcho, Kawaguchi, Saitama 332-0012, Japan. FAU - Baba, Seiki AU - Baba S AD - Japan Synchrotron Radiation Research Institute, 1-1-1, Kouto, Sayo-cho, Sayo-gun, Hyogo 679-5198, Japan. FAU - Yamashita, Keitaro AU - Yamashita K AD - RIKEN SPring-8 Center, 1-1-1 Kouto, Sayo-cho, Sayo-gun, Hyogo 679-5148, Japan. FAU - Hirata, Kunio AU - Hirata K AD - RIKEN SPring-8 Center, 1-1-1 Kouto, Sayo-cho, Sayo-gun, Hyogo 679-5148, Japan. AD - Japan Science and Technology Agency, Precursory Research for Embryonic Science and Technology (PRESTO), 4-1-8 Honcho, Kawaguchi, Saitama 332-0012, Japan. FAU - Ueno, Go AU - Ueno G AD - RIKEN SPring-8 Center, 1-1-1 Kouto, Sayo-cho, Sayo-gun, Hyogo 679-5148, Japan. FAU - Nomura, Takashi AU - Nomura T AUID- ORCID: 0000-0002-4613-7403 AD - RIKEN SPring-8 Center, 1-1-1 Kouto, Sayo-cho, Sayo-gun, Hyogo 679-5148, Japan. FAU - Kimura, Tetsunari AU - Kimura T AUID- ORCID: 0000-0003-1650-7298 AD - Graduate School of Science, Kobe University, 1-1 Rokkodai, Nada, Kobe, Hyogo 657-8501, Japan. FAU - Shinzawa-Itoh, Kyoko AU - Shinzawa-Itoh K AD - Picobiology Institute, Graduate School of Life Science, University of Hyogo, 3-2-1 Kouto, Kamigori-cho, Ako-gun, Hyogo 678-1297, Japan. FAU - Baba, Junpei AU - Baba J AD - Picobiology Institute, Graduate School of Life Science, University of Hyogo, 3-2-1 Kouto, Kamigori-cho, Ako-gun, Hyogo 678-1297, Japan. FAU - Hatano, Keita AU - Hatano K AD - Picobiology Institute, Graduate School of Life Science, University of Hyogo, 3-2-1 Kouto, Kamigori-cho, Ako-gun, Hyogo 678-1297, Japan. FAU - Eto, Yuki AU - Eto Y AD - Picobiology Institute, Graduate School of Life Science, University of Hyogo, 3-2-1 Kouto, Kamigori-cho, Ako-gun, Hyogo 678-1297, Japan. FAU - Miyamoto, Akari AU - Miyamoto A AD - Picobiology Institute, Graduate School of Life Science, University of Hyogo, 3-2-1 Kouto, Kamigori-cho, Ako-gun, Hyogo 678-1297, Japan. FAU - Murakami, Hironori AU - Murakami H AD - Japan Synchrotron Radiation Research Institute, 1-1-1, Kouto, Sayo-cho, Sayo-gun, Hyogo 679-5198, Japan. FAU - Kumasaka, Takashi AU - Kumasaka T AD - Japan Synchrotron Radiation Research Institute, 1-1-1, Kouto, Sayo-cho, Sayo-gun, Hyogo 679-5198, Japan. FAU - Owada, Shigeki AU - Owada S AUID- ORCID: 0000-0002-1451-7612 AD - RIKEN SPring-8 Center, 1-1-1 Kouto, Sayo-cho, Sayo-gun, Hyogo 679-5148, Japan. FAU - Tono, Kensuke AU - Tono K AUID- ORCID: 0000-0003-1218-3759 AD - Japan Synchrotron Radiation Research Institute, 1-1-1, Kouto, Sayo-cho, Sayo-gun, Hyogo 679-5198, Japan. FAU - Yabashi, Makina AU - Yabashi M AUID- ORCID: 0000-0002-2472-1684 AD - Japan Synchrotron Radiation Research Institute, 1-1-1, Kouto, Sayo-cho, Sayo-gun, Hyogo 679-5198, Japan. FAU - Yamaguchi, Yoshihiro AU - Yamaguchi Y AD - Picobiology Institute, Graduate School of Life Science, University of Hyogo, 1-1-1 Kouto, Sayo, Hyogo 679-5148, Japan. FAU - Yanagisawa, Sachiko AU - Yanagisawa S AD - Picobiology Institute, Graduate School of Life Science, University of Hyogo, 1-1-1 Kouto, Sayo, Hyogo 679-5148, Japan. FAU - Sakaguchi, Miyuki AU - Sakaguchi M AD - Picobiology Institute, Graduate School of Life Science, University of Hyogo, 1-1-1 Kouto, Sayo, Hyogo 679-5148, Japan. FAU - Ogura, Takashi AU - Ogura T AD - Picobiology Institute, Graduate School of Life Science, University of Hyogo, 1-1-1 Kouto, Sayo, Hyogo 679-5148, Japan. FAU - Komiya, Ryo AU - Komiya R AD - Department of Mechanical Engineering, Keio University, 3-14-1 Hiyoshi, Kohoku-ku, Yokohama 223-8522, Japan. FAU - Yan, Jiwang AU - Yan J AD - Department of Mechanical Engineering, Keio University, 3-14-1 Hiyoshi, Kohoku-ku, Yokohama 223-8522, Japan. FAU - Yamashita, Eiki AU - Yamashita E AD - Institute for Protein Research, Osaka University, 3-2 Yamadaoka, Suita, Osaka 565-0871, Japan. FAU - Yamamoto, Masaki AU - Yamamoto M AD - RIKEN SPring-8 Center, 1-1-1 Kouto, Sayo-cho, Sayo-gun, Hyogo 679-5148, Japan. FAU - Ago, Hideo AU - Ago H AD - RIKEN SPring-8 Center, 1-1-1 Kouto, Sayo-cho, Sayo-gun, Hyogo 679-5148, Japan. FAU - Yoshikawa, Shinya AU - Yoshikawa S AUID- ORCID: 0000-0002-6020-0974 AD - Picobiology Institute, Graduate School of Life Science, University of Hyogo, 3-2-1 Kouto, Kamigori-cho, Ako-gun, Hyogo 678-1297, Japan. FAU - Tsukihara, Tomitake AU - Tsukihara T AD - Picobiology Institute, Graduate School of Life Science, University of Hyogo, 3-2-1 Kouto, Kamigori-cho, Ako-gun, Hyogo 678-1297, Japan. AD - Institute for Protein Research, Osaka University, 3-2 Yamadaoka, Suita, Osaka 565-0871, Japan. AD - Japan Science and Technology Agency, Core Research for Evolutional Science and Technology (CREST), 4-1-8 Honcho, Kawaguchi, Saitama 332-0012, Japan. LA - eng PT - Journal Article PT - Research Support, Non-U.S. Gov't DEP - 20170714 PL - United States TA - Sci Adv JT - Science advances JID - 101653440 RN - 42VZT0U6YR (Heme) RN - 7U1EE4V452 (Carbon Monoxide) RN - EC 1.9.3.1 (Electron Transport Complex IV) SB - IM MH - Carbon Monoxide/*chemistry/*metabolism MH - Electron Transport Complex IV/*chemistry/*metabolism MH - Heme/chemistry/metabolism MH - Hydrogen Bonding MH - Models, Molecular MH - Molecular Conformation MH - Molecular Structure MH - Oxidation-Reduction MH - Photolysis MH - Structure-Activity Relationship PMC - PMC5510965 EDAT- 2017/07/26 06:00 MHDA- 2019/07/02 06:00 PMCR- 2017/07/14 CRDT- 2017/07/26 06:00 PHST- 2016/12/02 00:00 [received] PHST- 2017/06/14 00:00 [accepted] PHST- 2017/07/26 06:00 [entrez] PHST- 2017/07/26 06:00 [pubmed] PHST- 2019/07/02 06:00 [medline] PHST- 2017/07/14 00:00 [pmc-release] AID - 1603042 [pii] AID - 10.1126/sciadv.1603042 [doi] PST - epublish SO - Sci Adv. 2017 Jul 14;3(7):e1603042. doi: 10.1126/sciadv.1603042. eCollection 2017 Jul.