#CCP4I VERSION CCP4Interface 8.0.008
#CCP4I SCRIPT DEF mrbump
#CCP4I DATE 20 Jan 2023  12:52:52
#CCP4I USER 'UNKNOWN'
ACORNRES                  1.7
ACORN_FLAG                1
ACYC                      5
ARPWARP                   0
AUTOTRACE_AVAILABLE       0
BCYC                      10
BUCCANEER                 1
CHAINID,0                 ""
CHECK                     1
CLEAN                     0
CLUSTER                   0
CLUSTER_QUEUE             0
DBOUT                     0
DBVIEW                    0
DEBUG                     0
DIR_FIXED_XYZIN,0         ""
DIR_HKLIN                 "Full path.."
DIR_HKLOUT                Lyso-T
DIR_SEQIN                 "Full path.."
DIR_XYZIN,0               ""
DIR_XYZOUT                Lyso-T
DOFASTA                   0
DOHHPRED                  1
DOPHMMER                  1
ENANT_FLAG                1
ENSMODNUM                 1
ENSNUM                    1
EVALUE                    0.02
F                         ""
FASTALOCAL                0
FIDEN,0                   0.0
FIXED_XYZIN,0             ""
FREE                      ""
GESE                      0
GEST                      0
HHDBPDB                   ""
HHINDEX                   ""
HHLIB                     ""
HHRFILE                   ""
HHSCORE                   1
HKLIN                     C:/DATA/Marek/2023/CB080/molrep/lyso-2016-HD_sg96.mtz
HKLOUT                    lyso-2016-HD_sg96_mrbump_soln1.mtz
HPROXYSERVER              ""
HSPROXYSERVER             ""
HTMLOUT                   0
I                         ""
IGNORE                    ""
INCLUDE                   ""
INPUT_FILES               "HKLIN SEQIN"
LITE                      0
LOCALFILE                 ""
LOCALID,0                 ""
LOC_CHAINID,0             ""
LOC_COPIES,0              0
LOC_RMS,0                 0.0
MAPROGRAM                 MAFFT
MDLC                      1
MDLD                      0
MDLM                      1
MDLP                      0
MDLS                      1
MDLU                      0
MRBUMP_MODE               FULLMR
MRNUM                     30
MR_PROGRAM_LIST           ""
NCHAINIDS                 0
NCYC                      30
NFIXED                    0
NLOCAL                    0
NMASU                     ""
NPDBIDS                   0
NPKEY                     0
OUTPUT_FILES              "HKLOUT XYZOUT"
PACK                      ""
PDBDIR                    ""
PDBID,0                   ""
PDBLOCAL                  ""
PDBSERVER                 NOTSET
PJOBS                     ""
PKEYWORD,0                ""
PQSSEARCH                 0
PREPDIR                   ""
PROXYSERVER               ""
QSUBCOM                   ""
REFTWIN                   0
RESHTML                   ""
RESOLUTION_MAX            1.550
RLEVELVALUE               100
ROOTDIR                   ""
SCOPSEARCH                0
SCYC                      15
SEARCHPROG                Phmmer
SEQIN                     C:/DATA/Marek/2023/CB080/molrep/1JUG.fasta.pir
SGALL                     0
SHELXE                    0
SIGF                      ""
SIGI                      ""
SPACE_GROUP               "P 43 21 2"
SSMSEARCH                 0
SXRA                      0
SXRB                      1
SXRE                      0
TITLE                     01_MrBump
TOG_INTENSITY_OPTION      1
TRUNCATE                  1
TRYALL                    0
UPDATE                    0
USEACORN                  0
USEENANT                  0
USE_MOLREP                1
USE_PHASER                1
XYZIN,0                   ""
XYZOUT                    lyso-2016-HD_sg96_mrbump_soln1.pdb

