Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "60904480e146d39547c4ae23a80fcdf7",
"space_group_name": "P 21 21 2",
"unit_cell": {
"a": 98.86,
"b": 121.30,
"c": 47.31,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.90800],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [24.26,1.95],
"number_observations_unique": 42368,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.109
},
{
"type": "I/SigI",
"value": 13.2
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 8.0
}
]
},
"refln_shells": [
{
"resolution_limits": [2.06,1.95],
"number_observations_unique": 6130,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.377
},
{
"type": "I/SigI",
"value": 1.9
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 8.1
}
]
},
{
"resolution_limits": [2.18,2.06],
"number_observations_unique": 5747,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.259
},
{
"type": "I/SigI",
"value": 2.5
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 8.1
}
]
},
{
"resolution_limits": [2.33,2.18],
"number_observations_unique": 5430,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.216
},
{
"type": "I/SigI",
"value": 2.5
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 8.1
}
]
},
{
"resolution_limits": [2.52,2.33],
"number_observations_unique": 5086,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.160
},
{
"type": "I/SigI",
"value": 4.4
},
{
"type": "Completeness",
"value": 99.8
},
{
"type": "Redundancy",
"value": 8.1
}
]
},
{
"resolution_limits": [2.76,2.52],
"number_observations_unique": 4706,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.129
},
{
"type": "I/SigI",
"value": 5.1
},
{
"type": "Completeness",
"value": 99.8
},
{
"type": "Redundancy",
"value": 8.1
}
]
},
{
"resolution_limits": [3.08,2.76],
"number_observations_unique": 4259,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.100
},
{
"type": "I/SigI",
"value": 6.5
},
{
"type": "Completeness",
"value": 99.7
},
{
"type": "Redundancy",
"value": 8.1
}
]
},
{
"resolution_limits": [3.56,3.08],
"number_observations_unique": 3779,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.076
},
{
"type": "I/SigI",
"value": 7.9
},
{
"type": "Completeness",
"value": 99.6
},
{
"type": "Redundancy",
"value": 8.0
}
]
},
{
"resolution_limits": [4.36,3.56],
"number_observations_unique": 3234,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.064
},
{
"type": "I/SigI",
"value": 8.9
},
{
"type": "Completeness",
"value": 99.4
},
{
"type": "Redundancy",
"value": 7.9
}
]
},
{
"resolution_limits": [6.17,4.36],
"number_observations_unique": 2549,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.074
},
{
"type": "I/SigI",
"value": 7.2
},
{
"type": "Completeness",
"value": 98.9
},
{
"type": "Redundancy",
"value": 7.8
}
]
},
{
"resolution_limits": [24.26,6.17],
"number_observations_unique": 1448,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.061
},
{
"type": "I/SigI",
"value": 9.3
},
{
"type": "Completeness",
"value": 96.8
},
{
"type": "Redundancy",
"value": 7.2
}
]
}
]
}