Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "1a128ba83d85880ceaf38bc0ea4217fd",
"space_group_name": "P 41 21 2",
"unit_cell": {
"a": 65.92,
"b": 65.92,
"c": 89.39,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97948],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [29.476,2.11],
"number_observations_unique": 11917,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.120
},
{
"type": "I/SigI",
"value": 9.680
},
{
"type": "Completeness",
"value": 99.900
}
]
},
"refln_shells": [
{
"resolution_limits": [2.19,2.11],
"number_observations": 11570,
"number_observations_unique": 2296,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.986
},
{
"type": "I/SigI",
"value": 1.6
},
{
"type": "Completeness",
"value": 99.90
}
]
},
{
"resolution_limits": [2.27,2.19],
"number_observations": 10090,
"number_observations_unique": 1995,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.751
},
{
"type": "I/SigI",
"value": 2.1
},
{
"type": "Completeness",
"value": 99.90
}
]
},
{
"resolution_limits": [2.38,2.27],
"number_observations": 11511,
"number_observations_unique": 2268,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.654
},
{
"type": "I/SigI",
"value": 2.5
},
{
"type": "Completeness",
"value": 99.80
}
]
},
{
"resolution_limits": [2.50,2.38],
"number_observations": 10517,
"number_observations_unique": 2066,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.566
},
{
"type": "I/SigI",
"value": 2.9
},
{
"type": "Completeness",
"value": 100.00
}
]
},
{
"resolution_limits": [2.66,2.50],
"number_observations": 11360,
"number_observations_unique": 2219,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.398
},
{
"type": "I/SigI",
"value": 4.0
},
{
"type": "Completeness",
"value": 100.00
}
]
},
{
"resolution_limits": [2.86,2.66],
"number_observations": 10904,
"number_observations_unique": 2132,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.256
},
{
"type": "I/SigI",
"value": 6.1
},
{
"type": "Completeness",
"value": 100.00
}
]
},
{
"resolution_limits": [3.15,2.86],
"number_observations": 11134,
"number_observations_unique": 2179,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.161
},
{
"type": "I/SigI",
"value": 9.3
},
{
"type": "Completeness",
"value": 100.00
}
]
},
{
"resolution_limits": [3.60,3.15],
"number_observations": 11056,
"number_observations_unique": 2155,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.086
},
{
"type": "I/SigI",
"value": 16.0
},
{
"type": "Completeness",
"value": 100.00
}
]
},
{
"resolution_limits": [4.53,3.60],
"number_observations": 11125,
"number_observations_unique": 2172,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.053
},
{
"type": "I/SigI",
"value": 23.9
},
{
"type": "Completeness",
"value": 100.00
}
]
},
{
"resolution_limits": [29.476,4.53],
"number_observations": 11294,
"number_observations_unique": 2204,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.041
},
{
"type": "I/SigI",
"value": 28.2
},
{
"type": "Completeness",
"value": 99.50
}
]
}
]
}