对于数据集:空备注200在最高分辨率外壳中备注200。备注200最高分辨率外壳,范围高(A):1.90备注200最高分辨率外壳,范围低(A):1.97备注200壳体完整性(%):98.6REMARK 200 SHELL中的数据冗余:NULL备注200 R壳体合并(I):空壳体注释200 R SYM(I):空备注200对于外壳:空备注200备注200衍射协议:单波长备注200用于确定结构的方法:分子替换备注200使用的软件:CNS备注200启动模型:空备注200备注200备注:空备注280备注280晶体备注280溶剂含量VS(%):40.03备注280马修斯系数,VM(安氏**3/DA):2.05备注280备注280结晶条件:PEG6000、醋酸钠、TRIS、PH备注280 7.5,蒸汽扩散,坐滴,温度298K备注290备注290晶体对称性备注290空间群的对称算子:P 1 21 1备注290备注290对称性备注290 NNNMMM操作员备注290 1555 X,Y,Z备注290 2555-X,Y+1/2,-Z备注290备注290,其中NNN->操作员编号备注290 MMM->翻译向量备注290备注290晶体对称变换备注290以下变换作用于原子/混合体在本条目中备注290条记录,以制作结晶备注290个相关分子。备注290 SMTRY1 1 1.000000 0.000000 0.000000 0.000000 0.00000备注290 SMTRY2 1 0.000000 1.000000 0.000000 0.00000备注290 SMTRY3 1 0.000000 0.000000 1.000000 0.00000备注290 SMTRY1 2-1.00000000.000000 0.000000 0.00000备注290 SMTRY2 2 0.000000 1.000000 0.000000 28.97950备注290平方米3 2 0.000000 0.000000-1.000000 0.00000备注290备注290备注:空备注300备注300生物分子:1,2备注300有关作者提供的和/或程序,请参阅备注350备注300中生成的结构装配信息备注300这个条目。备注还可能提供有关备注300埋地面积。备注350记下代表已知的完整乘数的350个坐标备注350生物意义上的齐聚状态备注350应用生物转化可以生成分子记住下面给出的350。非晶态和备注:给出了350个晶体分析操作。备注350备注350生物分子:1备注350作者确定的生物单位:DIMERIC备注350软件确定的四元结构:DIMERIC备注350使用的软件:PISA备注350总埋地面积:3940安**2备注复合体的350表面积:10730安**2备注350无溶剂能量变化:-18.0 KCAL/MOL备注350将以下内容应用于链条:A、B备注350生物量1 1.000000 0.000000 0.000000 0.000000 0.00000备注350 BIOMT2 1 0.000000 1.000000 0.000000 0.00000备注350生物3 1 0.000000 0.000000 1.000000 0.00000备注350备注350生物分子:2备注350作者确定的生物单位:DIMERIC备注350软件确定的四元结构:DIMERIC备注350使用的软件:PISA备注350总埋地面积:4100安**2备注复合体的350表面积:10700安**2备注350无溶剂能量变化:-20.0 KCAL/MOL备注350将以下内容应用于链条:C、D备注350生物量1 1.000000 0.000000 0.000000 0.000000 0.00000备注350 BIOMT2 1 0.000000 1.000000 0.000000 0.00000备注350生物3 1 0.000000 0.000000 1.000000 0.00000备注500评论500几何学和立体化学备注500主题:扭转角备注500在预期的拉马钱德兰区域外标注500个扭转角:备注500(M=型号;RES=剩余名称;C=链标识符;备注500 SSEQ=序列号;I=插入代码)。备注500备注500标准表:备注500格式:(10X,I3,1X,A3,1X,A1,I4,A1,4X,F7.2,3X,F7.2)备注500备注500个预期值:GJ KLEYWEGT和TA JONES(1996)。PHI/PSI-记下500首合唱:拉马钱德朗重温。结构4,1395-1400备注500备注500 M RES CSSEQI PSI PHI备注500 ASN C 77 36.87-148.88备注500备注500备注:空备注800备注800站点备注800站点标识符:AC1备注800证据_代码:软件备注800场地_说明:剩余FMN A 1123的结合场地备注800备注800站点标识符:AC2备注800证据_代码:软件备注800位置_描述:剩余FMN B 2123的粘合位置备注800备注800站点标识符:AC3备注800证据_代码:软件备注800位置_描述:残留物的粘合位置FMN C 3123备注800备注800站点标识符:AC4备注800证据_代码:软件备注800位置_描述:残留物FMN D 4123的粘合位置备注900备注900个相关条目备注900相关ID:1FLM相关DB:PDB备注900相关ID:1WLI相关DB:PDB备注900 L122Y MUTANT备注900相关ID:1WLL相关DB:PDB备注900 L122K MUTANTDBREF 1WLK A 1 122 UNP Q46604 FMNB_DESVM 1 122数据库参考1WLK B 1 122 UNP Q46604 FMNB_DESVM 1 122DBREF 1WLK C 1 122 UNP Q46604 FMNB_DESVM 1 122DBREF 1walk D 1 122取消p Q46604 FMNB_DESVM 1 122SEQADV 1WLK GLU A 122 UNP Q46604 LEU 122工程突变SEQADV 1WLK GLU B 122 UNP Q46604 LEU 122工程突变SEQADV 1walk GLU C 122 UNP Q46604 LEU 122工程突变SEQADV 1walk GLU D 122 UNP Q46604 LEU 122工程突变序列1 A 122 MET LEU PRO GLY THR PHE GLU VAL LEU LYS ASN GLU序列2 A 122 GLY VAL ALA ILE ALA THR GLN GLY GLU ASP GLY PRO序列3 A 122 HIS LEU VAL ASN THR TRP ASN SER TYR LEU LYS VAL LEU序列4 A 122 ASP GLY ASN ARG ILE VAL VAL PRO VAL GLY GLY MET HIS序列5 A 122 LYS THR GLU ALA ASN VAL ALA ARG ASP GLU ARG VAL LEU序列6 A 122 MET THR LEU GLY SER ARG LYS VAL ALA GLY ARG ASN GLY序列7 A 122 PRO GLY THR GLY PHE LEU ILE ARG GLY SER ALA ALA PHE序列8 A 122 ARG THR ASP GLY PRO GLU PHE GLU ALA ILE ALA ARG PHE序列9 A 122 LYS TRP ALA ARG ALA ALA LEU VAL ILE THR VAL VAL SER序列10 A 122 ALA GLU GLN THR GLU序列1 B 122 MET LEU PRO GLY THR PHE GLU VAL LEU LYS ASN GLU序列2 B 122 GLY VAL ALA ILE ALA THR GLN GLY GLU ASP GLY PRO序列3 B 122 HIS LEU VAL ASN THR TRP ASN SER TYR LEU LYS VAL LEU序列4 B 122 ASP GLY ASN ARG ILE VAL VAL PRO VAL GLY GLY MET HIS序列5 B 122 LYS THR GLU ALA ASN VAL ALA ARG ASP GLU ARG VAL LEU序列6 B 122 MET THR LEU GLY SER ARG LYS VAL ALA GLY ARG ASN GLY序列7 B 122 PRO GLY THR GLY PHE LEU ILE ARG GLY SER ALA ALA PHE序列8 B 122 ARG THR ASP GLY PRO GLU PHE GLU ALA ILE ALA ARG PHE序列9 B 122 LYS TRP ALA ARG ALA ALA LEU VAL ILE THR VAL VAL SER序列10 B 122 ALA GLU GLN THR GLU序列1 C 122 MET LEU PRO GLY THR PHE GLU VAL LEU LYS ASN GLU序列2 C 122 GLY VAL ALA ILE ALA THR GLN GLY GLU ASP GLY PRO序列3 C 122 HIS LEU VAL ASN THR TRP ASN SER TYR LEU LYS VAL LEU序列4 C 122 ASP GLY ASN ARG ILE VAL VAL PRO VAL GLY GLY MET HIS序列5 C 122 LYS THR GLU ALA ASN VAL ALA ARG ASP GLU ARG VAL LEU序列6 C 122 MET THR LEU GLY SER ARG LYS VAL ALA GLY ARG ASN GLY序列7 C 122 PRO GLY THR GLY PHE LEU ILE ARG GLY SER ALA ALA PHE序列8 C 122 ARG THR ASP GLY PRO GLU PHE GLU ALA ILE ALA ARG PHE序列9 C 122 LYS TRP ALA ARG ALA ALA LEU VAL ILE THR VAL VAL SER序列10 C 122 ALA GLU GLN THR GLU序列1 D 122 MET LEU PRO GLY THR PHE GLU VAL LEU LYS ASN GLU序列2 D 122 GLY VAL ALA ILE ALA THR GLN GLY GLU ASP GLY PRO序列3 D 122 HIS LEU VAL ASN THR TRP ASN SER TYR LEU LYS VAL LEUSEQRES 4 D 122 ASP GLY as n ARG ILE VAL VAL PRO VAL GLY遇到了他的序列5 D 122 LYS THR GLU ALA ASN VAL ALA ARG ASP GLU ARG VAL LEU序列6 D 122 MET THR LEU GLY SER ARG LYS VAL ALA GLY ARG ASN GLY第7天第122页序列8 D 122 ARG THR ASP GLY PRO GLU PHE GLU ALA ILE ALA ARG PHE序列9 D 122 LYS TRP ALA ARG ALA ALA LEU VAL ILE THR VAL VAL SER序列10 D 122 ALA GLU GLN THR GLUHET FMN A1123 31号HET FMN B2123 31HET FMN C3123 31HET FMN D4123 31号HETNAM FMN FLAVIN单核苷酸海森FMN核黄素单磷酸盐配方5 FMN 4(C17 H21 N4 O9 P)配方9 HOH*420(H2 O)螺旋1 1 PRO A 3 LEU A 10 1 8螺旋2 2 SER A 34 LEU A 36 5 3螺旋3 3 MET A 51 ASP A 61 1 11螺旋线4 4 GLY A 95 ALA A 100 1 6螺旋5 5 PRO B 3 LYS B 11 1 9螺旋6 6 SER B 34 LEU B 36 5 3螺旋7 7 MET B 51 ASP B 61 1 11螺旋8 8 ASP B 94 ALA B 102 1 9螺旋9 9 PRO C 3 LYS C 11 1 9螺旋10 10 SER C 34 LEU C 36 5 3螺旋11 11 MET C 51 ASP C 61 1 11螺旋12 12 GLY C 95 ALA C 100 1 6螺旋13 13 PRO D 3 LYS D 11 1 9螺旋14 14 SER D 34 LEU D 36 5 3螺旋15 15 MET D 51 ASP D 61 1 11螺旋16 16 GLY D 95 ALA D 100 1 6表1 A 7 PRO A 26 TRP A 32 0表2 A 7 VAL A 15 GLN A 21-1 N ILE A 18 O VAL A 29表3 A 7 ARG A 63 ALA A 74-1 O LEU A 65 N ALA 19表4 A 7 PRO A 79 ARG A 92-1 O ILE A 85 N MET A 66表5 A 7 ALA A 109 GLU A 122-1 O VAL A 112 N ALA 90表6 A 7 ARG A 43 VAL A 48-1 N ILE A 44 O ILE A 113表7 A 7 LYS A 37 LEU A 39-1 N LYS A37 O VAL A 45表1 B 7 PRO B 26 TRP B 32 0表2 B 7阀门B 15 GLN B 21-1 N阀门B 16 O THR B 31表3 B 7 ARG B 63 ALA B 74-1 O LEU B 65 N ALA B 19表4 B 7 PRO B 79 ARG B 92-1 O ILE B 85 N MET B 66表5 B 7 ALA B 109 GLU B 122-1 O VAL B 112 N ALA B 90表6 B 7 ARG B 43 VAL B 48-1 N文件B 44 O文件B 113表7 B 7 LYS B 37 LEU B 39-1 N LYS B 37 O VAL B 45表1 C 7 GLY C 25 TRP C 32 0表2 C 7 VAL C 15 GLY C 22-1 N ILE C 18 O VAL C 29表3 C 7 ARG C 63 ALA C 74-1 O LEU C 65 N ALA C 19表4 C 7 PRO C 79 ARG C 92-1 O ILE C 85 N MET C 66表5 C 7 ALA C 109 GLU C 122-1 O VAL C 116 N ARG C 86表6 C 7 ARG C 43 VAL C 48-1 N ILE C 44 O ILE C 113表7 C 7 LYS C 37 LEU C 39-1 N LYS C 37 O VAL C 45表1 D 7 PRO D 26 TRP D 32 0表2 D 7 VAL D 15 GLN D 21-1 N ILE D 18 O VAL D 29表3 D 7 ARG D 63 ALA D 74-1 O LEU D 65 N ALA D 19表4 D 7 PRO D 79 ARG D 92-1 O ILE D 85 N MET D 66表5 D 7 ALA D 109 GLU D 122-1 O VAL D 112 N ALA D 90表6 D 7 ARG D 43 VAL D 48-1 N ILE D 44 O ILE D 113表7 D 7 LYS D 37 LEU D 39-1 N LYS D37 O VAL D 45站点1 AC1 21 HIS A 27 VAL A 29 ASN A 30 THR A 31站点2 AC1 21 TRP A 32 TYR A 35 PRO A 47 VAL A 48站点3 AC1 21 GLY A 49 GLY A 50遇到A 51 HIS A 52站点4 AC1 21 LYS A 53 THR A 54 HOH A1139 HOH A1140站点5 AC1 21 HOH A1152 GLY B 82 THR B 121 GLU B 122站点6 AC1 21 HOH B2160站点1 AC2 21 GLY A 82 THR A 121 GLU A 122 HIS B 27站点2 AC2 21 VAL B 29 ASN B 30 THR B 31 TRP B 32站点3 AC2 21 TYR B 35 PRO B 47 VAL B 48 GLY B 49站点4 AC2 21 GLY B 50 MET B 51 HIS B 52 LYS B 53站点5 AC2 21 THR B 54 TRP B 106 HOH B2136 HOH B2158站点6 AC2 21 HOH B2159站点1 AC3 21 VAL C 15 HIS C 27 VAL C 29 ASN C 30站点2 AC3 21 THR C 31 TRP C 32 TYR C 35 PRO C 47站点3 AC3 21 GLY C 49 GLY C 50 MET C 51 HIS C 52站点4 AC3 21 LYS C 53 THR C 54 TRP C 106 HOH C3131站点5 AC3 21 HOH C3156 GLY D 82 THR D 121 GLU D 122现场6 AC3 21 HOH D4201现场1 AC4 24 GLY C 82 THR C 121 GLU C 122 HOH C3138位点2 AC4 24 HOH C3159 HIS D 27 VAL D 29 ASN D 30站点3 AC4 24 THR D 31 TRP D 32 TYR D 35 PRO D 47站点4 AC4 24 VAL D 48 GLY D 49 GLY D 50 MET D 51位点5 AC4 24 HIS D 52 LYS D 53 THR D 54 TRP D 106地点6 AC4 24小时D4151小时D4157小时D4228小时D4230晶体1 60.164 57.959 62.018 90.00 91.54 90.00 P 1 21 1 8原始X1 1.000000 0.000000 0.000000 0.00000 0.00000ORIGX2 0.000000 1.000000 0.000000 0.00000 0.00000ORIGX3 0.000000 0.000000 1.0000000.00000比例尺1 0.016621 0.000000 0.000448 0.00000比例尺2 0.000000 0.017254 0.000000 0.00000比例尺3 0.000000 0.000000 0.016130 0.00000