Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "a42b468578d69a6ce6beac4410166dfe",
"space_group_name": "F 2 3",
"unit_cell": {
"a": 170.281,
"b": 170.281,
"c": 170.281,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.93928],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [34.76,2.750],
"number_observations_unique": 10743,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.120
},
{
"type": "I/SigI",
"value": 16.200
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 12.500
}
]
},
"refln_shells": [
{
"resolution_limits": [2.900,2.750],
"number_observations": 19745,
"number_observations_unique": 1555,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.016
},
{
"type": "I/SigI",
"value": 0.500
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 12.700
}
]
},
{
"resolution_limits": [3.070,2.900],
"number_observations": 18452,
"number_observations_unique": 1457,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.016
},
{
"type": "I/SigI",
"value": 0.700
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 12.700
}
]
},
{
"resolution_limits": [3.290,3.070],
"number_observations": 17657,
"number_observations_unique": 1395,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.016
},
{
"type": "I/SigI",
"value": 1.300
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 12.700
}
]
},
{
"resolution_limits": [3.550,3.290],
"number_observations": 16318,
"number_observations_unique": 1291,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.016
},
{
"type": "I/SigI",
"value": 2.200
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 12.600
}
]
},
{
"resolution_limits": [3.890,3.550],
"number_observations": 15101,
"number_observations_unique": 1198,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.016
},
{
"type": "I/SigI",
"value": 3.500
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 12.600
}
]
},
{
"resolution_limits": [4.350,3.890],
"number_observations": 13572,
"number_observations_unique": 1078,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.016
},
{
"type": "I/SigI",
"value": 8.700
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 12.600
}
]
},
{
"resolution_limits": [5.020,4.350],
"number_observations": 11924,
"number_observations_unique": 960,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.016
},
{
"type": "I/SigI",
"value": 11.400
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 12.400
}
]
},
{
"resolution_limits": [6.150,5.020],
"number_observations": 10039,
"number_observations_unique": 815,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.016
},
{
"type": "I/SigI",
"value": 10.400
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 12.300
}
]
},
{
"resolution_limits": [8.700,6.150],
"number_observations": 7692,
"number_observations_unique": 642,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.016
},
{
"type": "I/SigI",
"value": 14.100
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 12.000
}
]
},
{
"resolution_limits": [28.783,8.700],
"number_observations": 4053,
"number_observations_unique": 352,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.016
},
{
"type": "I/SigI",
"value": 18.300
},
{
"type": "Completeness",
"value": 96.200
},
{
"type": "Redundancy",
"value": 11.500
}
]
}
]
}